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3-[(1'-Butylpentyl)carbonyl]thiophene
SpectraBase Compound ID EyrEjO6jB2C
InChI InChI=1S/C14H22OS/c1-3-5-7-12(8-6-4-2)14(15)13-9-10-16-11-13/h9-12H,3-8H2,1-2H3
InChIKey BNRNQSFZVBPAOS-UHFFFAOYSA-N
Mol Weight 238.39 g/mol
Molecular Formula C14H22OS
Exact Mass 238.139137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FReViFNCNN8
Name 3-[(1'-Butylpentyl)carbonyl]thiophene
Alternate Name(s) 2-Butyl-1-(3-thienyl)-1-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22OS
InChI InChI=1S/C14H22OS/c1-3-5-7-12(8-6-4-2)14(15)13-9-10-16-11-13/h9-12H,3-8H2,1-2H3
InChIKey BNRNQSFZVBPAOS-UHFFFAOYSA-N
Molecular Weight 238.389 g/mol
SMILES c1(C(=O)C(CCCC)CCCC)cscc1
SPLASH splash10-03di-1900000000-655cc89fc728bbad041b
Source of Spectrum SK-20-2745-3
Wiley ID 851663