Dataset

3-hydroxy-C8-homoserine lactone

This MassBank record with Accession MSBNK-BGC_Munich-RP021502 contains the MS2 mass spectrum of 3-hydroxy-C8-homoserine lactone with the InChIkey XCZVBYOXRSFQBH-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H21NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h9-10,14H,2-8H2,1H3,(H,13,15)
SMILES CCCCCC(O)CC(=O)NC1CCOC1=O
InChI Key XCZVBYOXRSFQBH-UHFFFAOYSA-N
Molecular Formula C12H21NO4
Exact Mass 243.147 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BGC_Munich-RP021502
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:31:44.659547
MetadataModified 2025-02-09T08:47:11.173430
MetadataPublished 2017-10-25
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
16689230 PubChem: Thomson Pharma
PD048777 ProbesDrugs
182651 ChEBI
SCHEMBL15930076 SureChEMBL
DTXSID20469014 EPA CompTox Dashboard
J2.423.881D Nikkaji
232969 Brenda
11586792 PubChem
The data in this table is sourced from UniChem at EBI.