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1,2-Cyclopropanediacetonitrile, 1,2-diphenyl-, trans-
SpectraBase Compound ID INf1T0in7Ev
InChI InChI=1S/C19H16N2/c20-13-11-18(16-7-3-1-4-8-16)15-19(18,12-14-21)17-9-5-2-6-10-17/h1-10H,11-12,15H2/t18-,19-/m1/s1
InChIKey DDXMHNMGSJCEOF-RTBURBONSA-N
Mol Weight 272.35 g/mol
Molecular Formula C19H16N2
Exact Mass 272.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEv0EkddzEr
Name 1,2-Cyclopropanediacetonitrile, 1,2-diphenyl-, trans-
Alternate Name(s) trans-1,2-diphenyl-1,2-dicyanocyclopropane [(1S,2S)-2-(cyanomethyl)-1,2-diphenylcyclopropyl]acetonitrile
CAS Registry Number 111977-19-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2
InChI InChI=1S/C19H16N2/c20-13-11-18(16-7-3-1-4-8-16)15-19(18,12-14-21)17-9-5-2-6-10-17/h1-10H,11-12,15H2/t18-,19-/m1/s1
InChIKey DDXMHNMGSJCEOF-RTBURBONSA-N
Molecular Weight 272.351 g/mol
SMILES [C@@]1([C@](c2ccccc2)(CC#N)C1)(c1ccccc1)CC#N
SPLASH splash10-0udl-7940000000-3bd628a30ce0a5a34ac1
Source of Spectrum C-110-499-15
Wiley ID 1276678