For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Benzyl nona-3,8-dienoate

View entire compound with spectra: 1 MS (GC)

Benzyl nona-3,8-dienoate
SpectraBase Compound ID 9wOgrILfOGp
InChI InChI=1S/C16H20O2/c1-2-3-4-5-6-10-13-16(17)18-14-15-11-8-7-9-12-15/h2,6-12H,1,3-5,13-14H2
InChIKey ZHFSKXDIDDBNKR-UHFFFAOYSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5wHSFcWFqWG
Name Benzyl nona-3,8-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-2-3-4-5-6-10-13-16(17)18-14-15-11-8-7-9-12-15/h2,6-12H,1,3-5,13-14H2
InChIKey ZHFSKXDIDDBNKR-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201901383
Molecular Weight 244.334 g/mol
Reported Formula C16H20O2
SMILES C=CCCCC=CCC(=O)OCc1ccccc1
SPLASH splash10-0udi-0900000000-d22a415d8a8b5bd02355
Sample Comments E/Z = 78:22
Source of Spectrum ASC-362-SM5-3h
Wiley ID 1838216