Dataset

Himbacine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81390 contains the MS mass spectrum of Himbacine with the InChIkey FMPNFDSPHNUFOS-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C22H35NO2/c1-14-7-6-9-17(23(14)3)11-12-19-18-10-5-4-8-16(18)13-20-21(19)15(2)25-22(20)24/h11-12,14-21H,4-10,13H2,1-3H3
SMILES CC1CCCC(N1C)C=CC2C3CCCCC3CC4C2C(OC4=O)C
InChI Key FMPNFDSPHNUFOS-UHFFFAOYSA-N
Molecular Formula C22H35NO2
Exact Mass 345.267 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81390
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:23:57.268548
MetadataModified 2024-01-11T22:23:57.421405
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
HMDB0253171 Human Metabolome Database
PD045482 ProbesDrugs
1205 PubChem
The data in this table is sourced from UniChem at EBI.