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Benzonitrile, 4-(decahydro-6-pentyl-2-naphthalenyl)-, (2.alpha.,4a.alpha.,6.beta.,8a.beta.)-
SpectraBase Compound ID Lsn25vRbE87
InChI InChI=1S/C22H31N/c1-2-3-4-5-17-6-11-22-15-21(13-12-20(22)14-17)19-9-7-18(16-23)8-10-19/h7-10,17,20-22H,2-6,11-15H2,1H3/t17-,20-,21+,22+/m0/s1
InChIKey QYGMNZLXQGLFCZ-GUGJDKNPSA-N
Mol Weight 309.5 g/mol
Molecular Formula C22H31N
Exact Mass 309.24565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7a4bof4WpIx
Name Benzonitrile, 4-(decahydro-6-pentyl-2-naphthalenyl)-, (2.alpha.,4a.alpha.,6.beta.,8a.beta.)-
CAS Registry Number 83838-66-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31N
InChI InChI=1S/C22H31N/c1-2-3-4-5-17-6-11-22-15-21(13-12-20(22)14-17)19-9-7-18(16-23)8-10-19/h7-10,17,20-22H,2-6,11-15H2,1H3/t17-,20-,21+,22+/m0/s1
InChIKey QYGMNZLXQGLFCZ-GUGJDKNPSA-N
Molecular Weight 309.497 g/mol
SMILES C(#N)c1ccc([C@]2(C[C@]3(CC[C@@](C[C@@]3(CC2)[H])(CCCCC)[H])[H])[H])cc1
SPLASH splash10-0ap3-9833000000-0dfadd663ea79ad7929e
Source of Spectrum H-65-1253-0
Synonyms 4-[(2R,4aS,6S,8aR)-6-pentyldecahydro-2-naphthalenyl]benzonitrile 4-[6.beta.-pentyl-2.alpha.-(4a.alpha.,8a.beta.)-decahydronaphthyl]benzonitrile
Wiley ID 1310902