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2-[(Octadecyloxy)methyl]cyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID 9H8NiS6qmZX
InChI InChI=1S/C25H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-22-23-21-24(26)18-19-25(23)27/h18-19,21H,2-17,20,22H2,1H3
InChIKey BWOMYAHBCBUWNO-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C25H42O3
Exact Mass 390.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1r1WglyR16
Name 2-[(Octadecyloxy)methyl]cyclohexa-2,5-diene-1,4-dione
Alternate Name(s) 2-((octadecyloxy)methyl)cyclohexa-2,5-diene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H42O3
InChI InChI=1S/C25H42O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28-22-23-21-24(26)18-19-25(23)27/h18-19,21H,2-17,20,22H2,1H3
InChIKey BWOMYAHBCBUWNO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.200690059
Molecular Weight 390.608 g/mol
SMILES C1(C(=CC(C=C1)=O)COCCCCCCCCCCCCCCCCCC)=O
SPLASH splash10-0006-9300000000-0f24b631068b4295409d
Source of Spectrum CBD-3-564-11g
Wiley ID 1790276