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5H-Dibenzo[a,d]cycloheptene-10,11-diacetonitrile, 10,11-dihydro-, (10R-trans)-
SpectraBase Compound ID 8BTl7PbhGrA
InChI InChI=1S/C19H16N2/c20-11-9-18-16-7-3-1-5-14(16)13-15-6-2-4-8-17(15)19(18)10-12-21/h1-8,18-19H,9-10,13H2/t18-,19-/m0/s1
InChIKey RSXGHAVXGDTWCG-OALUTQOASA-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 1KCPmWw4mMi
Name 5H-Dibenzo[a,d]cycloheptene-10,11-diacetonitrile, 10,11-dihydro-, (10R-trans)-
Alternate Name(s) (10R,11R)-10,11-Biscyanomethyl-dibenzo[c,d]cycloheptane [(10R,11R)-11-(cyanomethyl)-10,11-dihydro-5H-dibenzo[a,d]cyclohepten-10-yl]acetonitrile
CAS Registry Number 115474-52-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16N2
InChI InChI=1S/C19H16N2/c20-11-9-18-16-7-3-1-5-14(16)13-15-6-2-4-8-17(15)19(18)10-12-21/h1-8,18-19H,9-10,13H2/t18-,19-/m0/s1
InChIKey RSXGHAVXGDTWCG-OALUTQOASA-N
Molecular Weight 272.351 g/mol
SMILES [C@@]1([C@](c2c(cccc2)Cc2c1cccc2)(CC#N)[H])(CC#N)[H]
SPLASH splash10-0006-0920000000-710d5a70dc17b942fc6d
Source of Spectrum F-43-4957-22
Wiley ID 1276679