For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-4-[(3-carbomethoxy-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-keto-but-2-enoic acid
SpectraBase Compound ID 8MsSKphXvE0
InChI InChI=1S/C13H13NO5S/c1-19-13(18)11-7-3-2-4-8(7)20-12(11)14-9(15)5-6-10(16)17/h5-6H,2-4H2,1H3,(H,14,15)(H,16,17)/b6-5+
InChIKey YBYMBGPWJJKZNZ-AATRIKPKSA-N
Mol Weight 295.31 g/mol
Molecular Formula C13H13NO5S
Exact Mass 295.051444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DmSWZInAjEp
Name (E)-4-[(3-carbomethoxy-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-keto-but-2-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO5S
InChI InChI=1S/C13H13NO5S/c1-19-13(18)11-7-3-2-4-8(7)20-12(11)14-9(15)5-6-10(16)17/h5-6H,2-4H2,1H3,(H,14,15)(H,16,17)/b6-5+
InChIKey YBYMBGPWJJKZNZ-AATRIKPKSA-N
Molecular Weight 295.309 g/mol
SMILES N(c1c(c2CCCc2s1)C(=O)OC)C(\C=C\C(=O)O)=O
SPLASH splash10-00kb-5910000000-fb89f0ac1fc740243c23
Synonyms (E)-4-[(3-methoxycarbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxidanylidene-but-2-enoic acid (E)-4-[(3-methoxycarbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxo-2-butenoic acid (E)-4-[(3-methoxycarbonyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxo-but-2-enoic acid
Wiley ID 1453324