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docos-15-en-1-yl benzoate
SpectraBase Compound ID 2c8rNKpVLhX
InChI InChI=1S/C29H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-31-29(30)28-25-22-21-23-26-28/h7-8,21-23,25-26H,2-6,9-20,24,27H2,1H3
InChIKey QZGRDEYLIXXYOP-UHFFFAOYSA-N
Mol Weight 428.7 g/mol
Molecular Formula C29H48O2
Exact Mass 428.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nJtj3mS7w6
Name docos-15-en-1-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O2
InChI InChI=1S/C29H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-27-31-29(30)28-25-22-21-23-26-28/h7-8,21-23,25-26H,2-6,9-20,24,27H2,1H3
InChIKey QZGRDEYLIXXYOP-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 6890N-Agilent Technologies 5975B
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.201900153
Molecular Weight 428.701 g/mol
SMILES CCCCCCC=CCCCCCCCCCCCCCCOC(=O)c1ccccc1
SPLASH splash10-0ac1-9500000000-d381d2f6600456632a4f
Source of Spectrum CBD-16-SM22-Fig. S23(B)
Wiley ID 1838401