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3-Amino-5-diphenyl(cyano)methyl-2-nitrothiophene
SpectraBase Compound ID 7IzTCoSf41M
InChI InChI=1S/C18H13N3O2S/c19-12-18(13-7-3-1-4-8-13,14-9-5-2-6-10-14)16-11-15(20)17(24-16)21(22)23/h1-11H,20H2
InChIKey OEDKLPKTLREPSX-UHFFFAOYSA-N
Mol Weight 335.38 g/mol
Molecular Formula C18H13N3O2S
Exact Mass 335.072848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdhCgLF8Tfq
Name 3-Amino-5-diphenyl(cyano)methyl-2-nitrothiophene
Alternate Name(s) (4-amino-5-nitro-2-thienyl)(diphenyl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13N3O2S
InChI InChI=1S/C18H13N3O2S/c19-12-18(13-7-3-1-4-8-13,14-9-5-2-6-10-14)16-11-15(20)17(24-16)21(22)23/h1-11H,20H2
InChIKey OEDKLPKTLREPSX-UHFFFAOYSA-N
Molecular Weight 335.381 g/mol
SMILES Nc1c(sc(C(C#N)(c2ccccc2)c2ccccc2)c1)N(=O)=O
SPLASH splash10-000i-0159000000-e4a44f228e3517ca3d7f
Source of Spectrum SO-0-1633-15
Wiley ID 876040