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2-[[(2-fluorophenyl)-oxomethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID Av85nOgRhNJ
InChI InChI=1S/C19H20FNO3S/c1-2-24-19(23)16-13-9-4-3-5-11-15(13)25-18(16)21-17(22)12-8-6-7-10-14(12)20/h6-8,10H,2-5,9,11H2,1H3,(H,21,22)
InChIKey KSAGZEBPWRVMKF-UHFFFAOYSA-N
Mol Weight 361.43 g/mol
Molecular Formula C19H20FNO3S
Exact Mass 361.114793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IWXuegG6A2F
Name 2-[[(2-fluorophenyl)-oxomethyl]amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylic acid ethyl ester
Alternate Name(s) Ethyl 2-[(2-fluorobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate Ethyl 2-[(2-fluorophenyl)carbonylamino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
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Formula C19H20FNO3S
InChI InChI=1S/C19H20FNO3S/c1-2-24-19(23)16-13-9-4-3-5-11-15(13)25-18(16)21-17(22)12-8-6-7-10-14(12)20/h6-8,10H,2-5,9,11H2,1H3,(H,21,22)
InChIKey KSAGZEBPWRVMKF-UHFFFAOYSA-N
Molecular Weight 361.431 g/mol
SMILES N(c1c(c2c(CCCCC2)s1)C(OCC)=O)C(c1c(cccc1)F)=O
SPLASH splash10-0229-3719000000-38cfb5e337314847c735
Wiley ID 1456353