Dataset

AOA, AOAA, Aminooxyacetic acid Hemihydrochloride, CMO, Aminooxyacetic acid, Carboxymethoxylamine

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS077001 contains the MS2 mass spectrum of AOA, AOAA, Aminooxyacetic acid Hemihydrochloride, CMO, Aminooxyacetic acid, Carboxymethoxylamine with the InChIkey NQRKYASMKDDGHT-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C2H5NO3/c3-6-1-2(4)5/h1,3H2,(H,4,5)
SMILES	C(C(=O)O)ON
InChI Key	NQRKYASMKDDGHT-UHFFFAOYSA-N
Molecular Formula	C2H5NO3
Exact Mass	91.066 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN_ReSpect-PS077001
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T21:36:55.221031
MetadataModified	2025-02-09T19:06:48.671846
MetadataPublished	2009-02-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
CHEMBL347862	ChEMBL
AOA	PDBe
5136	Guide to Pharmacology
DTXSID50214756	EPA CompTox Dashboard
MCULE-4566186819	Mcule
40823	ChEBI
HMDB0248327	Human Metabolome Database
J36.275A	Nikkaji
DB02079	DrugBank
217753	Brenda
SCHEMBL98144	SureChEMBL
ZINC000004689151	ZINC
CB31248204	ChemicalBook
51288	Brenda
92440	Brenda
172051	Brenda
5138	Brenda
59189	Brenda
5732	Brenda
1554	Brenda
57030	Brenda
92862	Brenda
286	PubChem
15339066	PubChem: Thomson Pharma
14I68GI3OQ	FDA SRS
PD008572	ProbesDrugs
972365	eMolecules
The data in this table is sourced from UniChem at EBI.