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Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-6-tert-butyl-2-cyclopropanoylamino-, ethyl ester
SpectraBase Compound ID 3mHx0MGgnWC
InChI InChI=1S/C19H27NO3S/c1-5-23-18(22)15-13-9-8-12(19(2,3)4)10-14(13)24-17(15)20-16(21)11-6-7-11/h11-12H,5-10H2,1-4H3,(H,20,21)
InChIKey BDSWZNQFCZRKSB-UHFFFAOYSA-N
Mol Weight 349.49 g/mol
Molecular Formula C19H27NO3S
Exact Mass 349.171165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5qI1kXASXC
Name Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-6-tert-butyl-2-cyclopropanoylamino-, ethyl ester
Alternate Name(s) 6-tert-Butyl-2-(cyclopropanecarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester 6-tert-Butyl-2-[[cyclopropyl(oxo)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 6-tert-butyl-2-(cyclopropanecarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Ethyl 6-tert-butyl-2-(cyclopropanecarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 6-tert-butyl-2-(cyclopropylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Formula C19H27NO3S
InChI InChI=1S/C19H27NO3S/c1-5-23-18(22)15-13-9-8-12(19(2,3)4)10-14(13)24-17(15)20-16(21)11-6-7-11/h11-12H,5-10H2,1-4H3,(H,20,21)
InChIKey BDSWZNQFCZRKSB-UHFFFAOYSA-N
Molecular Weight 349.489 g/mol
SMILES N(C(=O)C1CC1)c1c(c2CCC(Cc2s1)C(C)(C)C)C(OCC)=O
SPLASH splash10-00kf-9431000000-9c6e47c612cd8bd3ae63
Source of Spectrum AD-0-2532-0
Wiley ID 1426660