Dataset

2-Isopropyl-6-methyl-pyrimidin-4-ol

This MassBank record with Accession MSBNK-Athens_Univ-AU287003 contains the MS2 mass spectrum of 2-Isopropyl-6-methyl-pyrimidin-4-ol with the InChIkey AJPIUNPJBFBUKK-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)
SMILES	CC(C)C1=NC(C)=CC(=O)N1
InChI Key	AJPIUNPJBFBUKK-UHFFFAOYSA-N
Molecular Formula	C8H12N2O
Exact Mass	152.095 g/mol

Data and Resources

2-Isopropyl-6-methyl-pyrimidin-4-olHTML
Explore
- More information
- Go to resource

Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU287003
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:48:09.988057
MetadataModified	2024-01-11T09:48:10.153623
MetadataPublished	2019-05-31

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
MCULE-4922392122	Mcule
0JET159MZQ	FDA SRS
502515	eMolecules
33419224	eMolecules
135444498	PubChem
CB6760735	ChemicalBook
38629	ChEBI
CHEMBL3183282	ChEMBL
130887	Brenda
MTBLC38629	Metabolights
MTBLC83445	Metabolights
59538	Brenda
16129918	PubChem: Thomson Pharma
70094237	NMRShiftDB
83445	ChEBI
16858-17-6	ACToR
2814-20-2	ACToR
SCHEMBL190354	SureChEMBL
ZINC000008816069	ZINC
SABKIR	CCDC
233379	Brenda
DTXSID1027502	EPA CompTox Dashboard
J13.007I	Nikkaji
HMDB0245733	Human Metabolome Database
The data in this table is sourced from UniChem at EBI.