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(1R,2S,5S)-2,4-Dimethyl-5-(3-methylbut-2-enyl)cyclohex-3-enecarbonitrile
SpectraBase Compound ID FDyHnkmCtEh
InChI InChI=1S/C14H21N/c1-10(2)5-6-13-8-14(9-15)12(4)7-11(13)3/h5,7,12-14H,6,8H2,1-4H3/t12-,13-,14-/m0/s1
InChIKey FTAAHYVGEZGFEF-IHRRRGAJSA-N
Mol Weight 203.33 g/mol
Molecular Formula C14H21N
Exact Mass 203.1674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qpByQ1ZByE
Name (1R,2S,5S)-2,4-Dimethyl-5-(3-methylbut-2-enyl)cyclohex-3-enecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21N
InChI InChI=1S/C14H21N/c1-10(2)5-6-13-8-14(9-15)12(4)7-11(13)3/h5,7,12-14H,6,8H2,1-4H3/t12-,13-,14-/m0/s1
InChIKey FTAAHYVGEZGFEF-IHRRRGAJSA-N
Molecular Weight 203.329 g/mol
SMILES C1=C([C@](C[C@]([C@]1(C)[H])(C#N)[H])(CC=C(C)C)[H])C
SPLASH splash10-014i-9000000000-6429797bf2fc02c77332
Source of Spectrum F-65-10503-24
Synonyms (1RS,2SR,5SR)-2,4-Dimethyl-5-(3-methylbut-2-enyl)cyclohex-3-enecarbonitrile
Wiley ID 1712313