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1,2-Benzenediacetonitrile, .alpha.,.alpha.'-dimethyl-, (R*,R*)-(.+-.)-
SpectraBase Compound ID 2xL0VDyUl87
InChI InChI=1S/C12H12N2/c1-9(7-13)11-5-3-4-6-12(11)10(2)8-14/h3-6,9-10H,1-2H3/t9-,10-/m0/s1
InChIKey WMOOLDJYGNIHGI-UWVGGRQHSA-N
Mol Weight 184.24 g/mol
Molecular Formula C12H12N2
Exact Mass 184.100048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4odcXUHxOC
Name 1,2-Benzenediacetonitrile, .alpha.,.alpha.'-dimethyl-, (R*,R*)-(.+-.)-
Alternate Name(s) (2R)-2-{2-[(1R)-1-cyanoethyl]phenyl}propanenitrile O-bis(cyanoethyl)benzene
CAS Registry Number 59508-35-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2
InChI InChI=1S/C12H12N2/c1-9(7-13)11-5-3-4-6-12(11)10(2)8-14/h3-6,9-10H,1-2H3/t9-,10-/m0/s1
InChIKey WMOOLDJYGNIHGI-UWVGGRQHSA-N
Molecular Weight 184.242 g/mol
SMILES c1(c([C@](C#N)(C)[H])cccc1)[C@](C#N)(C)[H]
SPLASH splash10-05o0-0900000000-352d8f53c4bcb17f38fe
Source of Spectrum F-32-490-0
Wiley ID 1181174