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1-(2,6-Dichlorophenyl)-4-(5-nitro-3-thenoyl)semicarbazide

View entire compound with spectra: 1 NMR, and 1 FTIR

1-(2,6-Dichlorophenyl)-4-(5-nitro-3-thenoyl)semicarbazide
SpectraBase Compound ID 9dSCjS1tx3N
InChI InChI=1S/C12H8Cl2N4O4S/c13-7-2-1-3-8(14)10(7)16-17-12(20)15-11(19)6-4-9(18(21)22)23-5-6/h1-5,16H,(H2,15,17,19,20)
InChIKey HPDHXZLHEIYACF-UHFFFAOYSA-N
Mol Weight 375.19 g/mol
Molecular Formula C12H8Cl2N4O4S
Exact Mass 373.964331 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 42cOn8dxQNV
Name 1-(2,6-Dichlorophenyl)-4-(5-nitro-3-thenoyl)semicarbazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.964331324 u
Formula C12H8Cl2N4O4S
InChI InChI=1S/C12H8Cl2N4O4S/c13-7-2-1-3-8(14)10(7)16-17-12(20)15-11(19)6-4-9(18(21)22)23-5-6/h1-5,16H,(H2,15,17,19,20)
InChIKey HPDHXZLHEIYACF-UHFFFAOYSA-N
Molecular Weight 375.186 g/mol
SMILES N(C(C=1C=C(SC1)N(=O)=O)=O)C(=O)NNC1=C(Cl)C=CC=C1Cl