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14-oxidanylidene-1-phenyl-2-phenylazanyl-1-azacyclotetradec-2-ene-3-carbonitrile
SpectraBase Compound ID 4wg6c2TpanV
InChI InChI=1S/C26H31N3O/c27-21-22-15-9-5-3-1-2-4-6-14-20-25(30)29(24-18-12-8-13-19-24)26(22)28-23-16-10-7-11-17-23/h7-8,10-13,16-19,28H,1-6,9,14-15,20H2/b26-22+
InChIKey QFYSQRMTTDLDNW-XTCLZLMSSA-N
Mol Weight 401.55 g/mol
Molecular Formula C26H31N3O
Exact Mass 401.246713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8MzJVrxq8v5
Name 14-oxidanylidene-1-phenyl-2-phenylazanyl-1-azacyclotetradec-2-ene-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31N3O
InChI InChI=1S/C26H31N3O/c27-21-22-15-9-5-3-1-2-4-6-14-20-25(30)29(24-18-12-8-13-19-24)26(22)28-23-16-10-7-11-17-23/h7-8,10-13,16-19,28H,1-6,9,14-15,20H2/b26-22+
InChIKey QFYSQRMTTDLDNW-XTCLZLMSSA-N
Molecular Weight 401.554 g/mol
SMILES N(\C=1N(C(=O)CCCCCCCCCCC/1C#N)c1ccccc1)c1ccccc1
SPLASH splash10-0zi1-6491300000-0515f73889fdf087a7d8
Source of Spectrum F-52-4372-12
Synonyms 2-Anilino-14-keto-1-phenyl-1-azacyclotetradec-2-ene-3-carbonitrile 2-Anilino-14-oxo-1-phenyl-1-azacyclotetradec-2-ene-3-carbonitrile (2E)-2-anilino-14-oxo-1-phenyl-1-azacyclotetradec-2-ene-3-carbonitrile (2E)-14-oxidanylidene-1-phenyl-2-phenylazanyl-1-azacyclotetradec-2-ene-3-carbonitrile
Wiley ID 796051