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benzo[b]thiophene-2-carboxylic acid, 3-amino-6-nitro-, methyl ester
SpectraBase Compound ID J6nsJ6skDgD
InChI InChI=1S/C10H8N2O4S/c1-16-10(13)9-8(11)6-3-2-5(12(14)15)4-7(6)17-9/h2-4H,11H2,1H3
InChIKey AVWYTSRBVOQDRA-UHFFFAOYSA-N
Mol Weight 252.24 g/mol
Molecular Formula C10H8N2O4S
Exact Mass 252.020478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26lthVfAKOt
Name Methyl 3-amino-6-nitro-1-benzothiophene-2-carboxylate
CAS Registry Number 35212-90-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8N2O4S
InChI InChI=1S/C10H8N2O4S/c1-16-10(13)9-8(11)6-3-2-5(12(14)15)4-7(6)17-9/h2-4H,11H2,1H3
InChIKey AVWYTSRBVOQDRA-UHFFFAOYSA-N
Molecular Weight 252.244 g/mol
SMILES Nc1c(sc2cc(N(=O)=O)ccc12)C(=O)OC
SPLASH splash10-0fk9-3890000000-0162e4bd2f4e5860e9b0
Synonyms 3-Amino-6-nitro-1-benzothiophene-2-carboxylic acid methyl ester 3-Amino-6-nitro-benzothiophene-2-carboxylic acid methyl ester Benzothiophene-2-carboxylic acid, 3-amino-6-nitro-, methyl ester Methyl 3-amino-6-nitro-benzothiophene-2-carboxylate Methyl 3-azanyl-6-nitro-1-benzothiophene-2-carboxylate
Wiley ID 1455614