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1-(2-Thienyl)-1-propanone
SpectraBase Compound ID FABfsQMYgLW
InChI InChI=1S/C7H8OS/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3
InChIKey MFPZQZZWAMAHOY-UHFFFAOYSA-N
Mol Weight 140.2 g/mol
Molecular Formula C7H8OS
Exact Mass 140.029586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ek6iccH7mQR
Name 1-(2-Thienyl)-1-propanone
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 140.029586051 u
Formula C7H8OS
GC Column DB-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C7H8OS/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3
InChIKey MFPZQZZWAMAHOY-UHFFFAOYSA-N
Instrument Name Agilent series 7890B
Ionization Type EI
Literature Reference DOI 10.1021/acs.jafc.1c04415
Quality 468
SMILES C=1SC(=CC1)C(=O)CC
SPLASH splash10-03di-3900000000-f1b5b8e1ad1b895718b6
Source of Spectrum JAFC-70-SM16-16-1 (DOI: 10.1021/acs.jafc.1c04415)
Wiley ID 1911497