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1-(2-Thienyl)-1-pentanone

View entire compound with spectra: 1 NMR, 2 FTIR, 1 Raman, and 6 MS (GC)

1-(2-Thienyl)-1-pentanone
SpectraBase Compound ID 1Ds12yLANYY
InChI InChI=1S/C9H12OS/c1-2-3-5-8(10)9-6-4-7-11-9/h4,6-7H,2-3,5H2,1H3
InChIKey KJMPRCVRMAHTBR-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 FwsZePCFe04
Name 1-(2-Thienyl)-1-pentanone
CAS Registry Number 53119-25-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12OS
InChI InChI=1S/C9H12OS/c1-2-3-5-8(10)9-6-4-7-11-9/h4,6-7H,2-3,5H2,1H3
InChIKey KJMPRCVRMAHTBR-UHFFFAOYSA-N
Molecular Weight 168.254 g/mol
SMILES c1ccc(s1)C(CCCC)=O
SPLASH splash10-03fr-2900000000-b90d0e1d1a5d5d47f383
Source of Spectrum VC-1981-692-0
Synonyms 1-(2-Thienyl)pentan-1-one 1-Pentanone, 1-(2-thienyl)- 1-Thiophen-2-yl-1-pentanone 1-Thiophen-2-ylpentan-1-one 2-Pentanoylthiophene
Wiley ID 1164234