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2-Pentanone, 3-(2-thienyl)-
SpectraBase Compound ID Akljjwclmqg
InChI InChI=1S/C9H12OS/c1-3-8(7(2)10)9-5-4-6-11-9/h4-6,8H,3H2,1-2H3
InChIKey NBYHMFDDBVFUBK-UHFFFAOYSA-N
Mol Weight 168.25 g/mol
Molecular Formula C9H12OS
Exact Mass 168.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbkGqwHgujG
Name 2-Pentanone, 3-(2-thienyl)-
CAS Registry Number 71777-95-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12OS
InChI InChI=1S/C9H12OS/c1-3-8(7(2)10)9-5-4-6-11-9/h4-6,8H,3H2,1-2H3
InChIKey NBYHMFDDBVFUBK-UHFFFAOYSA-N
Molecular Weight 168.254 g/mol
SMILES c1(C(C(=O)C)CC)sccc1
SPLASH splash10-004j-5900000000-42c112a25ea9f2524d71
Source of Spectrum F-35-335-0
Synonyms 3-(2-Thienyl)-2-pentanone 3-Thiophen-2-yl-2-pentanone 3-Thiophen-2-ylpentan-2-one
Wiley ID 1164236