Dataset

Phytol,mixture of isomers, 3,7,11,15-Tetramethyl-2-hexadecen-1-ol

This MassBank record with Accession MSBNK-RIKEN_ReSpect-PS009705 contains the MS2 mass spectrum of Phytol,mixture of isomers, 3,7,11,15-Tetramethyl-2-hexadecen-1-ol with the InChIkey BOTWFXYSPFMFNR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C20H40O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h15,17-19,21H,6-14,16H2,1-5H3
SMILES CC(C)CCCC(C)CCCC(C)CCCC(=CCO)C
InChI Key BOTWFXYSPFMFNR-UHFFFAOYSA-N
Molecular Formula C20H40O
Exact Mass 296.539 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-PS009705
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:16:22.902599
MetadataModified 2025-02-09T19:09:36.805619
MetadataPublished 2009-02-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MCULE-2515703397 Mcule
DTXSID40859291 EPA CompTox Dashboard
145386 PubChem
PD056754 ProbesDrugs
7541-49-3 ACToR
The data in this table is sourced from UniChem at EBI.