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Indeno[7,1-bc]thiepin-5-carboxamide, 2,3,4,6-tetrahydro-7-methyl-6-oxo-
SpectraBase Compound ID 4mf7J5wg2f8
InChI InChI=1S/C14H13NO2S/c1-7-4-5-9-11-8(3-2-6-18-9)12(14(15)17)13(16)10(7)11/h4-5H,2-3,6H2,1H3,(H2,15,17)
InChIKey RXTMEQPIWIRTCB-UHFFFAOYSA-N
Mol Weight 259.32 g/mol
Molecular Formula C14H13NO2S
Exact Mass 259.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3k0oxj9YBc
Name Indeno[7,1-bc]thiepin-5-carboxamide, 2,3,4,6-tetrahydro-7-methyl-6-oxo-
Alternate Name(s) 3,4-Dihydro-2H-7-methyl-6-oxoindeno[7,1-bc]thiepin-5-carboxamide 7-Methyl-6-oxo-2,3,4,6-tetrahydroindeno[7,1-bc]thiepin-5-carboxamide
CAS Registry Number 40740-49-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO2S
InChI InChI=1S/C14H13NO2S/c1-7-4-5-9-11-8(3-2-6-18-9)12(14(15)17)13(16)10(7)11/h4-5H,2-3,6H2,1H3,(H2,15,17)
InChIKey RXTMEQPIWIRTCB-UHFFFAOYSA-N
Molecular Weight 259.323 g/mol
SMILES NC(C1=C2c3c(SCCC2)ccc(c3C1=O)C)=O
SPLASH splash10-0pi3-0590000000-3485d04c584c6a3d0017
Source of Spectrum Y-17-663-0
Wiley ID 1262656