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2-[[2-(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-napthalenyl)-1-cyclohexenyl]-1-ethenyl]-1-cyclopentanynitrile
SpectraBase Compound ID 1OWUP8APylu
InChI InChI=1S/C29H37N/c1-20-17-26-27(29(4,5)16-15-28(26,2)3)18-25(20)24-12-7-6-9-22(24)14-13-21-10-8-11-23(21)19-30/h13-14,17-18H,6-12,15-16H2,1-5H3/b14-13+
InChIKey WXPFAKLTROACRV-BUHFOSPRSA-N
Mol Weight 399.6 g/mol
Molecular Formula C29H37N
Exact Mass 399.2926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AyZIswEBUj7
Name 2-[[2-(5,6,7,8-tetrahydro-3,5,5,8,8-pentamethyl-2-napthalenyl)-1-cyclohexenyl]-1-ethenyl]-1-cyclopentanynitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H37N
InChI InChI=1S/C29H37N/c1-20-17-26-27(29(4,5)16-15-28(26,2)3)18-25(20)24-12-7-6-9-22(24)14-13-21-10-8-11-23(21)19-30/h13-14,17-18H,6-12,15-16H2,1-5H3/b14-13+
InChIKey WXPFAKLTROACRV-BUHFOSPRSA-N
Literature Reference DOI 10.1002/cjoc.20000180115
Molecular Weight 399.622 g/mol
SMILES C1CC(c2c(C1(C)C)cc(c(c2)C)C1=C(CCCC1)\C=C\C=1CCCC1C#N)(C)C
SPLASH splash10-000t-0109100000-1113ca36fc9121db03e1
Source of Spectrum CJC-18-82-12
Synonyms (E)-2-(2-(2-(3,5,5,8,8-pentamethyl-5,6,7,8-tetrahydronaphthalen-2-yl)cyclohex-1-en-1-yl)vinyl)cyclopent-1-enecarbonitrile
Wiley ID 1773464