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Thiophene
SpectraBase Compound ID GCqG1ueJB0w
InChI InChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H
InChIKey YTPLMLYBLZKORZ-UHFFFAOYSA-N
Mol Weight 84.14 g/mol
Molecular Formula C4H4S
Exact Mass 84.003371 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaWNKeRQa9S
Name Thiophene
Carrier Gas Helium (1 mL/min)
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Exact Mass 84.003371303 u
Formula C4H4S
GC Column DB-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H
InChIKey YTPLMLYBLZKORZ-UHFFFAOYSA-N
Instrument Name Agilent series 7890B
Ionization Type EI
Literature Reference DOI 10.1021/acs.jafc.1c04415
Molecular Weight 84.136 g/mol
Quality 640
SMILES C=1SC=CC1
SPLASH splash10-053s-9000000000-fa48010d8cd1400e0b04
Source of Spectrum JAFC-70-SM3-3-2 (DOI: 10.1021/acs.jafc.1c04415)
Wiley ID 1911504