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3-(4"-Nitrophenyl)-2-cyano-N-( 6'-methoxy-2'-benzothiazolyl)-2-propenamide
SpectraBase Compound ID JgnwijdcIHO
InChI InChI=1S/C18H12N4O4S/c1-26-14-6-7-15-16(9-14)27-18(20-15)21-17(23)12(10-19)8-11-2-4-13(5-3-11)22(24)25/h2-9H,1H3,(H,20,21,23)/b12-8+
InChIKey RPZCNRGBBGCUAF-XYOKQWHBSA-N
Mol Weight 380.38 g/mol
Molecular Formula C18H12N4O4S
Exact Mass 380.057926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JGzty4I4d3
Name 3-(4"-Nitrophenyl)-2-cyano-N-( 6'-methoxy-2'-benzothiazolyl)-2-propenamide
Alternate Name(s) (2E)-2-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(4-nitrophenyl)-2-propenamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N4O4S
InChI InChI=1S/C18H12N4O4S/c1-26-14-6-7-15-16(9-14)27-18(20-15)21-17(23)12(10-19)8-11-2-4-13(5-3-11)22(24)25/h2-9H,1H3,(H,20,21,23)/b12-8+
InChIKey RPZCNRGBBGCUAF-XYOKQWHBSA-N
Molecular Weight 380.378 g/mol
SMILES N(c1nc2ccc(cc2s1)OC)C(\C(=C\c1ccc(N(=O)=O)cc1)C#N)=O
SPLASH splash10-00ai-0903000000-6353db423f5c974b5e08
Source of Spectrum G-61-927-4
Wiley ID 748950