Dataset

GERMACRENE-B

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010678 contains the MS mass spectrum of GERMACRENE-B with the InChIkey GXEGJTGWYVZSNR-JEKCHIPQSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6+,14-9-
SMILES CC(=C1)CCC(CC=C(C)CC1)=C(C)C
InChI Key GXEGJTGWYVZSNR-JEKCHIPQSA-N
Molecular Formula C15H24
Exact Mass 204.188 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP010678
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:55:51.612849
MetadataModified 2024-01-11T15:55:51.774355
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
49315 ChEBI
15559495 PubChem
60025528 NMRShiftDB
LMPR0103090010 LipidMaps
ZINC000059200455 ZINC
MTBLC49315 Metabolights
The data in this table is sourced from UniChem at EBI.