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2H-Thiopyran-5-carbonitrile, 6-amino-2-[(4-methylphenyl)imino]-4-phenyl-
SpectraBase Compound ID 22W0iinGz
InChI InChI=1S/C19H15N3S/c1-13-7-9-15(10-8-13)22-18-11-16(14-5-3-2-4-6-14)17(12-20)19(21)23-18/h2-11H,21H2,1H3/b22-18-
InChIKey FABTWXJRJSAJMY-PYCFMQQDSA-N
Mol Weight 317.41 g/mol
Molecular Formula C19H15N3S
Exact Mass 317.098669 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CinV1qTQVAu
Name 2H-Thiopyran-5-carbonitrile, 6-amino-2-[(4-methylphenyl)imino]-4-phenyl-
Alternate Name(s) (2Z)-6-amino-2-[(4-methylphenyl)imino]-4-phenyl-2H-thiopyran-5-carbonitrile 2-p-tolylimino-4-phenyl-5-cyano-2H-thiopyran
CAS Registry Number 89815-87-2
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3S
InChI InChI=1S/C19H15N3S/c1-13-7-9-15(10-8-13)22-18-11-16(14-5-3-2-4-6-14)17(12-20)19(21)23-18/h2-11H,21H2,1H3/b22-18-
InChIKey FABTWXJRJSAJMY-PYCFMQQDSA-N
Molecular Weight 317.410 g/mol
SMILES NC1=C(C(=C\C(=N\c2ccc(cc2)C)S1)c1ccccc1)C#N
SPLASH splash10-0udi-0092000000-16870406c3b5295b2a46
Source of Spectrum AH-114-1194-0
Wiley ID 1317771