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2-[[(4-nitrophenyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

2-[[(4-nitrophenyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester
SpectraBase Compound ID JK7i9C8FMb4
InChI InChI=1S/C16H14N2O5S/c1-23-16(20)13-11-3-2-4-12(11)24-15(13)17-14(19)9-5-7-10(8-6-9)18(21)22/h5-8H,2-4H2,1H3,(H,17,19)
InChIKey VPBGUBAIGUYHMH-UHFFFAOYSA-N
Mol Weight 346.36 g/mol
Molecular Formula C16H14N2O5S
Exact Mass 346.062343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID mFI2SP7Mfa
Name 2-[[(4-nitrophenyl)-oxomethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid methyl ester
Alternate Name(s) Methyl 2-[(4-nitrobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate Methyl 2-[(4-nitrophenyl)carbonylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N2O5S
InChI InChI=1S/C16H14N2O5S/c1-23-16(20)13-11-3-2-4-12(11)24-15(13)17-14(19)9-5-7-10(8-6-9)18(21)22/h5-8H,2-4H2,1H3,(H,17,19)
InChIKey VPBGUBAIGUYHMH-UHFFFAOYSA-N
Molecular Weight 346.357 g/mol
SMILES N(C(=O)c1ccc(cc1)N(=O)=O)c1c(c2c(s1)CCC2)C(OC)=O
SPLASH splash10-01ot-1809000000-a0de0002c775fe63e755
Wiley ID 1453191