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2-cyclohexyl-2-[(1R,2R)-2-phenylcyclopropyl]propanenitrile
SpectraBase Compound ID 7Y8lLbaQjW7
InChI InChI=1S/C18H23N/c1-18(13-19,15-10-6-3-7-11-15)17-12-16(17)14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-12H2,1H3/t16-,17+,18?/m0/s1
InChIKey JEGQXGWCRJWJAF-MYFVLZFPSA-N
Mol Weight 253.39 g/mol
Molecular Formula C18H23N
Exact Mass 253.18305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JfXEdOSjKpW
Name 2-cyclohexyl-2-[(1R,2R)-2-phenylcyclopropyl]propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 253.183049745 u
Formula C18H23N
InChI InChI=1S/C18H23N/c1-18(13-19,15-10-6-3-7-11-15)17-12-16(17)14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-12H2,1H3/t16-,17+,18?/m0/s1
InChIKey JEGQXGWCRJWJAF-MYFVLZFPSA-N
Ionization Type EI
Molecular Weight 253.389 g/mol
Quality 208
Reported Formula C18H23N
SMILES C([C@]1([C@@](C1)(C1=CC=CC=C1)[H])[H])(C#N)(C)C1CCCCC1
SPLASH splash10-014i-3900000000-dba8a0db624f7fda2e7a
Source of Spectrum CN111362832B
Wiley ID 1894819