Dataset

1-Aminocyclopropanecarboxylic acid, 1-Aminocyclopropane-1-carboxylic acid, ACPC

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS002502 contains the MS2 mass spectrum of 1-Aminocyclopropanecarboxylic acid, 1-Aminocyclopropane-1-carboxylic acid, ACPC with the InChIkey PAJPWUMXBYXFCZ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C4H7NO2/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7)
SMILES C1CC1(C(=O)O)N
InChI Key PAJPWUMXBYXFCZ-UHFFFAOYSA-N
Molecular Formula C4H7NO2
Exact Mass 101.105 g/mol

Data and Resources

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-PS002502
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:16:19.900344
MetadataModified 2025-02-09T19:09:12.828854
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DB02085 DrugBank
C01234 KEGG Ligand
CHEMBL265325 ChEMBL
18053 ChEBI
58360 ChEBI
1AC PDBe
HY-30004 MedChemExpress
DTXSID9039577 EPA CompTox Dashboard
FOBJUB CCDC
J83.133F Nikkaji
6971063 PubChem
535 PubChem
60023628 NMRShiftDB
15170459 PubChem: Thomson Pharma
3K9EJ633GL FDA SRS
22059-21-8 ACToR
SCHEMBL61082 SureChEMBL
PD001372 ProbesDrugs
476742 eMolecules
153366 Brenda
42894 Brenda
139472 Brenda
18812 Brenda
1490 Brenda
6035 Brenda
117243 Brenda
136561 Brenda
HMDB0036458 Human Metabolome Database
58360 Rhea
CB6401146 ChemicalBook
ZINC000000895536 ZINC
MTBLC18053 Metabolights
MTBLC58360 Metabolights
95600 Brenda
MCULE-8788149299 Mcule
The data in this table is sourced from UniChem at EBI.