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1-(4-Methyl-5-pentadecyl-2-thienyl)-1-hexadecanone
SpectraBase Compound ID FvEmrCbgb5p
InChI InChI=1S/C36H66OS/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-34(37)36-32-33(3)35(38-36)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32H,4-31H2,1-3H3
InChIKey CEIKGQYUAFUHDH-UHFFFAOYSA-N
Mol Weight 547.0 g/mol
Molecular Formula C36H66OS
Exact Mass 546.483438 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KSwINm6GGsc
Name 1-(4-Methyl-5-pentadecyl-2-thienyl)-1-hexadecanone
CAS Registry Number 59782-69-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H66OS
InChI InChI=1S/C36H66OS/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-34(37)36-32-33(3)35(38-36)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32H,4-31H2,1-3H3
InChIKey CEIKGQYUAFUHDH-UHFFFAOYSA-N
Molecular Weight 546.983 g/mol
SMILES CCCCCCCCCCCCCCCc1c(C)cc(C(CCCCCCCCCCCCCCC)=O)s1
SPLASH splash10-0udi-8209010000-f626bd09476822f1fbf0
Source of Spectrum W6-0-0-0
Synonyms 1-(4-Methyl-5-pentadecyl-2-thienyl)hexadecan-1-one 1-(4-Methyl-5-pentadecyl-2-thiophenyl)-1-hexadecanone 1-(4-Methyl-5-pentadecyl-thiophen-2-yl)hexadecan-1-one 1-Hexadecanone, 1-(4-methyl-5-pentadecyl-2-thienyl)-
Wiley ID 126834