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Ethyl 2-formyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
SpectraBase Compound ID 5W9fgrYBJdl
InChI InChI=1S/C12H14O3S/c1-2-15-12(14)11-8-5-3-4-6-9(8)16-10(11)7-13/h7H,2-6H2,1H3
InChIKey KUQQSPPRIRUBRT-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZYVRkHjXNG
Name Ethyl 2-formyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
Appearance Light-yellow crystals
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Exact Mass 238.066365482 u
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-2-15-12(14)11-8-5-3-4-6-9(8)16-10(11)7-13/h7H,2-6H2,1H3
InChIKey KUQQSPPRIRUBRT-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202201048
Molecular Weight 238.301 g/mol
Reported Formula C12H14O3S
SMILES C1=2C(=C(SC2CCCC1)C=O)C(OCC)=O
SPLASH splash10-0a4l-8690000000-815ba390d05b106002c8
Source of Spectrum K1-2022-SM166-24c (DOI: 10.1002/ejoc.202201048)
Wiley ID 1907902