Dataset

Paracetamol; LC-ESI-FT; MS2; CE: 20,40,130%; R=30000; [M+H]+

This MassBank record with Accession MSBNK-UoB-XB000500 contains the MS2 mass spectrum of Paracetamol with the InChIkey RZVAJINKPMORJF-UHFFFAOYSA-N.

Chemical Information

InChI	InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
SMILES	CC(=O)NC1=CC=C(C=C1)O
InChI Key	RZVAJINKPMORJF-UHFFFAOYSA-N
Molecular Formula	C8H9NO2
Exact Mass	151.063 g/mol

Data and Resources

ParacetamolHTML

Go to source

Related Molecule ⌄

N-(4-hydroxyphenyl)acetamide

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000500
Version
Author
Maintainer
Language
MetadataPublished	2022-11-08
Related Molecule	N-(4-hydroxyphenyl)acetamide

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
DB00316	drugbank
NNS	rcsb_pdb
TYL	rcsb_pdb
CHEMBL112	chembl
3480	surechembl
1983	pubchem
362O9ITL9D	fdasrs
5239	gtopdb
PD002492	probes_and_drugs
COTZAN	CCDC
111336	brenda
111608	brenda
111868	brenda
114965	brenda
143804	brenda
19996	brenda
2541	brenda
257546	brenda
69698	brenda
7459	brenda
84044	brenda
TYL	pdbe
CHEBI:46195	chebi
HMDB0001859	hmdb
DTXSID2020006	comptox
NCT00000425	clinicaltrials
NCT00003346	clinicaltrials
NCT00012857	clinicaltrials
NCT00029770	clinicaltrials
NCT00029770	clinicaltrials
NCT00078559	clinicaltrials
NCT00092313	clinicaltrials
NCT00092326	clinicaltrials
NCT00110474	clinicaltrials
NCT00137566	clinicaltrials
NCT00137969	clinicaltrials
NCT00147355	clinicaltrials
NCT00152854	clinicaltrials
NCT00185692	clinicaltrials
NCT00186628	clinicaltrials
NCT00195728	clinicaltrials
NCT00210561	clinicaltrials
NCT00210847	clinicaltrials
NCT00236483	clinicaltrials
NCT00236535	clinicaltrials
NCT00240773	clinicaltrials
NCT00240786	clinicaltrials
NCT00240799	clinicaltrials
NCT00240825	clinicaltrials
NCT00240838	clinicaltrials
NCT00240851	clinicaltrials
NCT00240864	clinicaltrials
NCT00246168	clinicaltrials
NCT00261560	clinicaltrials
NCT00261586	clinicaltrials
NCT00267293	clinicaltrials
NCT00282347	clinicaltrials
NCT00292214	clinicaltrials
NCT00297375	clinicaltrials
NCT00298974	clinicaltrials
NCT00299039	clinicaltrials
NCT00299039	clinicaltrials
NCT00300924	clinicaltrials
NCT00314340	clinicaltrials
NCT00315445	clinicaltrials
NCT00324038	clinicaltrials
NCT00324467	clinicaltrials
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NCT00344045	clinicaltrials
NCT00370318	clinicaltrials
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NCT00378937	clinicaltrials
NCT00381810	clinicaltrials
NCT00382083	clinicaltrials
NCT00385684	clinicaltrials
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NCT03759028	clinicaltrials
NCT03763084	clinicaltrials
NCT03767933	clinicaltrials
NCT03768882	clinicaltrials
NCT03781505	clinicaltrials
NCT03781544	clinicaltrials
NCT03783702	clinicaltrials
NCT03786029	clinicaltrials
NCT03789318	clinicaltrials
NCT03792295	clinicaltrials
NCT03803371	clinicaltrials
NCT03805932	clinicaltrials
NCT03818919	clinicaltrials
NCT03818932	clinicaltrials
NCT03818932	clinicaltrials
NCT03820193	clinicaltrials
NCT03820193	clinicaltrials
NCT03822962	clinicaltrials
NCT03823534	clinicaltrials
NCT03823534	clinicaltrials
NCT03823534	clinicaltrials
NCT03824938	clinicaltrials
NCT03825198	clinicaltrials
NCT03825809	clinicaltrials
NCT03825809	clinicaltrials
NCT03830398	clinicaltrials
NCT03843281	clinicaltrials
NCT03846102	clinicaltrials
NCT03858231	clinicaltrials
NCT03858231	clinicaltrials
NCT03859024	clinicaltrials
NCT03865004	clinicaltrials
NCT03865147	clinicaltrials
NCT03878693	clinicaltrials
NCT03883893	clinicaltrials
NCT03885596	clinicaltrials
NCT03885596	clinicaltrials
NCT03893175	clinicaltrials
NCT03907176	clinicaltrials
NCT03910088	clinicaltrials
NCT03913559	clinicaltrials
NCT03918135	clinicaltrials
NCT03929640	clinicaltrials
NCT03947671	clinicaltrials
NCT03953287	clinicaltrials
NCT03955211	clinicaltrials
NCT03968146	clinicaltrials
NCT03974932	clinicaltrials
NCT03978767	clinicaltrials
NCT03987022	clinicaltrials
NCT03994731	clinicaltrials
NCT03997851	clinicaltrials
NCT04015557	clinicaltrials
NCT04015908	clinicaltrials
NCT04018612	clinicaltrials
NCT04028596	clinicaltrials
NCT04037514	clinicaltrials
NCT04038307	clinicaltrials
NCT04038346	clinicaltrials
NCT04066426	clinicaltrials
NCT04074174	clinicaltrials
NCT04093219	clinicaltrials
NCT04112550	clinicaltrials
NCT04122443	clinicaltrials
NCT04123873	clinicaltrials
NCT04144933	clinicaltrials
NCT04148495	clinicaltrials
NCT04149964	clinicaltrials
NCT04149964	clinicaltrials
NCT04165096	clinicaltrials
NCT04175509	clinicaltrials
NCT04176419	clinicaltrials
NCT04178109	clinicaltrials
NCT04199572	clinicaltrials
NCT04214691	clinicaltrials
NCT04221477	clinicaltrials
NCT04224558	clinicaltrials
NCT04230252	clinicaltrials
NCT04240626	clinicaltrials
NCT04246541	clinicaltrials
NCT04246554	clinicaltrials
NCT04246697	clinicaltrials
NCT04251351	clinicaltrials
NCT04259333	clinicaltrials
NCT04265456	clinicaltrials
NCT04268498	clinicaltrials
NCT04270409	clinicaltrials
NCT04271917	clinicaltrials
NCT04290208	clinicaltrials
NCT04291508	clinicaltrials
NCT04294459	clinicaltrials
NCT04307940	clinicaltrials
NCT04324606	clinicaltrials
NCT04360135	clinicaltrials
NCT04372264	clinicaltrials
NCT04399122	clinicaltrials
NCT04407234	clinicaltrials
NCT04414995	clinicaltrials
NCT04414995	clinicaltrials
NCT04416334	clinicaltrials
NCT04416334	clinicaltrials
NCT04423107	clinicaltrials
NCT04429022	clinicaltrials
NCT04447040	clinicaltrials
NCT04447040	clinicaltrials
NCT04447040	clinicaltrials
NCT04459117	clinicaltrials
NCT04495283	clinicaltrials
NCT04530149	clinicaltrials
NCT04532931	clinicaltrials
NCT04536051	clinicaltrials
NCT04551196	clinicaltrials
NCT04571996	clinicaltrials
NCT04574778	clinicaltrials
NCT04580121	clinicaltrials
NCT04608669	clinicaltrials
NCT04609254	clinicaltrials
NCT04612920	clinicaltrials
NCT04622735	clinicaltrials
NCT04622735	clinicaltrials
NCT04622813	clinicaltrials
NCT04622813	clinicaltrials
NCT04625608	clinicaltrials
NCT04629248	clinicaltrials
NCT04630834	clinicaltrials
NCT04640376	clinicaltrials
NCT04645966	clinicaltrials
NCT04646967	clinicaltrials
NCT04651556	clinicaltrials
NCT04660799	clinicaltrials
NCT04673214	clinicaltrials
NCT04673214	clinicaltrials
NCT04681105	clinicaltrials
NCT04682743	clinicaltrials
NCT04688788	clinicaltrials
NCT04694300	clinicaltrials
NCT04702256	clinicaltrials
NCT04726878	clinicaltrials
NCT04730297	clinicaltrials
NCT04741139	clinicaltrials
NCT04743661	clinicaltrials
NCT04762147	clinicaltrials
NCT04766996	clinicaltrials
NCT04769557	clinicaltrials
NCT04779567	clinicaltrials
NCT04788654	clinicaltrials
NCT04790812	clinicaltrials
NCT04791761	clinicaltrials
NCT04835116	clinicaltrials
NCT04835116	clinicaltrials
NCT04837924	clinicaltrials
NCT04840615	clinicaltrials
NCT04872270	clinicaltrials
NCT04872283	clinicaltrials
NCT04872322	clinicaltrials
NCT04879823	clinicaltrials
NCT04903509	clinicaltrials
NCT04905563	clinicaltrials
NCT04918147	clinicaltrials
NCT04920838	clinicaltrials
NCT04931693	clinicaltrials
NCT04939987	clinicaltrials
NCT04939987	clinicaltrials
NCT04949477	clinicaltrials
NCT04959591	clinicaltrials
NCT04963296	clinicaltrials
NCT04968158	clinicaltrials
NCT04976387	clinicaltrials
NCT04977336	clinicaltrials
NCT04986839	clinicaltrials
NCT04990388	clinicaltrials
NCT05013437	clinicaltrials
NCT05022810	clinicaltrials
NCT05024825	clinicaltrials
NCT05034952	clinicaltrials
NCT05039619	clinicaltrials
NCT05051735	clinicaltrials
NCT05070650	clinicaltrials
NCT05076110	clinicaltrials
NCT05088876	clinicaltrials
NCT05109312	clinicaltrials
NCT05118672	clinicaltrials
NCT05122351	clinicaltrials
NCT05129137	clinicaltrials
NCT05143762	clinicaltrials
NCT05154682	clinicaltrials
NCT05161221	clinicaltrials
NCT05204667	clinicaltrials
NCT05229965	clinicaltrials
NCT05246644	clinicaltrials
NCT05284409	clinicaltrials
NCT05285813	clinicaltrials
NCT05298683	clinicaltrials
NCT05316168	clinicaltrials
NCT05319730	clinicaltrials
NCT05340582	clinicaltrials
NCT05354479	clinicaltrials
NCT05361824	clinicaltrials
NCT05406752	clinicaltrials
NCT05413902	clinicaltrials
NCT05417997	clinicaltrials
NCT05425355	clinicaltrials
NCT05428293	clinicaltrials
NCT05428306	clinicaltrials
NCT05477875	clinicaltrials
NCT05488847	clinicaltrials
NCT05499234	clinicaltrials
NCT05511025	clinicaltrials
NCT05523102	clinicaltrials
NCT05529290	clinicaltrials
NCT05544734	clinicaltrials
NCT05544734	clinicaltrials
NCT05547659	clinicaltrials
NCT05553366	clinicaltrials
NCT05556356	clinicaltrials
NCT05557344	clinicaltrials
NCT05558410	clinicaltrials
NCT05563961	clinicaltrials
NCT05564819	clinicaltrials
NCT05597878	clinicaltrials
NCT05602064	clinicaltrials
NCT05603832	clinicaltrials
NCT05627557	clinicaltrials
NCT05630222	clinicaltrials
NCT05640674	clinicaltrials
NCT05640674	clinicaltrials
NCT05647681	clinicaltrials
NCT05661279	clinicaltrials
NCT05678244	clinicaltrials
NCT05685225	clinicaltrials
NCT05690282	clinicaltrials
NCT05704049	clinicaltrials
NCT05722002	clinicaltrials
NCT05722782	clinicaltrials
NCT05742763	clinicaltrials
NCT05761574	clinicaltrials
NCT05761574	clinicaltrials
NCT05764707	clinicaltrials
NCT05834569	clinicaltrials
NCT05842044	clinicaltrials
NCT05844995	clinicaltrials
NCT05845008	clinicaltrials
NCT05868122	clinicaltrials
NCT05878015	clinicaltrials
NCT05896228	clinicaltrials
NCT05919732	clinicaltrials
NCT05919732	clinicaltrials
NCT05919745	clinicaltrials
NCT05930171	clinicaltrials
NCT05965492	clinicaltrials
NCT05974423	clinicaltrials
NCT05974423	clinicaltrials
NCT05974501	clinicaltrials
NCT05995704	clinicaltrials
NCT06004687	clinicaltrials
NCT06019728	clinicaltrials
NCT06042426	clinicaltrials
NCT06043323	clinicaltrials
NCT06061575	clinicaltrials
NCT06076980	clinicaltrials
NCT06109415	clinicaltrials
NCT06109428	clinicaltrials
NCT06137469	clinicaltrials
NCT06149507	clinicaltrials
NCT06152796	clinicaltrials
NCT06180070	clinicaltrials
NCT06186622	clinicaltrials
NCT06187584	clinicaltrials
NCT06187584	clinicaltrials
NCT06212830	clinicaltrials
NCT06214468	clinicaltrials
NCT06245902	clinicaltrials
NCT06245902	clinicaltrials
NCT06256211	clinicaltrials
NCT06274333	clinicaltrials
NCT06294743	clinicaltrials
NCT06305754	clinicaltrials
NCT06326944	clinicaltrials
NCT06356571	clinicaltrials
NCT06371144	clinicaltrials
NCT06379425	clinicaltrials
NCT06417268	clinicaltrials
NCT06467318	clinicaltrials
NCT06479122	clinicaltrials
NCT06484439	clinicaltrials
Molport-000-150-777	molport
Molport-047-940-800	molport
52	drugcentral
26197	bindingdb
The data in this table is sourced from UniChem at EBI.