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Benzenepropanoic acid, 2-chloro-5-nitro-.beta.-[[2-(2-thienyl)acetyl]amino]-
SpectraBase Compound ID CrHmGLaE1DC
InChI InChI=1S/C15H13ClN2O5S/c16-12-4-3-9(18(22)23)6-11(12)13(8-15(20)21)17-14(19)7-10-2-1-5-24-10/h1-6,13H,7-8H2,(H,17,19)(H,20,21)
InChIKey WLMPUGNHHVMOTG-UHFFFAOYSA-N
Mol Weight 368.79 g/mol
Molecular Formula C15H13ClN2O5S
Exact Mass 368.02337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 75tSoLwxa1S
Name Benzenepropanoic acid, 2-chloro-5-nitro-.beta.-[[2-(2-thienyl)acetyl]amino]-
Alternate Name(s) 3-(2-Chloro-5-nitrophenyl)-3-[(1-oxo-2-thiophen-2-ylethyl)amino]propanoic acid 3-(2-Chloro-5-nitrophenyl)-3-[(2-thiophen-2-ylacetyl)amino]propanoic acid 3-(2-Chloro-5-nitro-phenyl)-3-[[2-(2-thienyl)acetyl]amino]propanoic acid 3-(2-Chloranyl-5-nitro-phenyl)-3-(2-thiophen-2-ylethanoylamino)propanoic acid
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Formula C15H13ClN2O5S
InChI InChI=1S/C15H13ClN2O5S/c16-12-4-3-9(18(22)23)6-11(12)13(8-15(20)21)17-14(19)7-10-2-1-5-24-10/h1-6,13H,7-8H2,(H,17,19)(H,20,21)
InChIKey WLMPUGNHHVMOTG-UHFFFAOYSA-N
Molecular Weight 368.791 g/mol
SMILES OC(CC(c1c(ccc(c1)N(=O)=O)Cl)NC(=O)Cc1sccc1)=O
SPLASH splash10-0002-9300000000-184a5a61aec0e986cf7e
Source of Spectrum IY-1-4458-1
Wiley ID 1652564