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1-[N'-(2-Cyano-3-oxocyclohex-1-yl)methyleneamino]-2-[(diphenyl)(methoxy)methyl]pyrrolidine
SpectraBase Compound ID 3hjtINYFX9Z
InChI InChI=1S/C26H29N3O2/c1-31-26(21-11-4-2-5-12-21,22-13-6-3-7-14-22)25-16-9-17-29(25)28-19-20-10-8-15-24(30)23(20)18-27/h2-7,11-14,19-20,23,25H,8-10,15-17H2,1H3/b28-19+
InChIKey MBJUSMHHGRAEOV-TURZUDJPSA-N
Mol Weight 415.54 g/mol
Molecular Formula C26H29N3O2
Exact Mass 415.225977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LWqqgdzKX2N
Name 1-[N'-(2-Cyano-3-oxocyclohex-1-yl)methyleneamino]-2-[(diphenyl)(methoxy)methyl]pyrrolidine
Alternate Name(s) 2-[(E)-({2-[methoxy(diphenyl)methyl]-1-pyrrolidinyl}imino)methyl]-6-oxocyclohexanecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H29N3O2
InChI InChI=1S/C26H29N3O2/c1-31-26(21-11-4-2-5-12-21,22-13-6-3-7-14-22)25-16-9-17-29(25)28-19-20-10-8-15-24(30)23(20)18-27/h2-7,11-14,19-20,23,25H,8-10,15-17H2,1H3/b28-19+
InChIKey MBJUSMHHGRAEOV-TURZUDJPSA-N
Molecular Weight 415.537 g/mol
SMILES C(C1N(\N=C\C2C(C#N)C(=O)CCC2)CCC1)(c1ccccc1)(c1ccccc1)OC
SPLASH splash10-001i-0096100000-b7acd24e85cb36655ccf
Source of Spectrum KC-61-4123-14
Wiley ID 1628791