Dataset

Warfarin

This MassBank record with Accession MSBNK-Eawag-EQ310305 contains the MS2 mass spectrum of Warfarin with the InChIkey QTXVAVXCBMYBJW-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,22H,11H2,1H3
SMILES O=C\1c3c(OC(/O)=C/1C(c2ccccc2)CC(=O)C)cccc3
InChI Key QTXVAVXCBMYBJW-UHFFFAOYSA-N
Molecular Formula C19H16O4
Exact Mass 308.105 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ310305
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T14:39:06.899555
MetadataModified 2024-01-11T14:39:07.058370
MetadataPublished 2015-08-25
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables