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Benzene, [1-methyl-5-(2-nitrocyclohexyl)-4-pentenyl]-
SpectraBase Compound ID 4oTgrnHvYth
InChI InChI=1S/C18H25NO2/c1-15(16-10-3-2-4-11-16)9-5-6-12-17-13-7-8-14-18(17)19(20)21/h2-4,6,10-12,15,17-18H,5,7-9,13-14H2,1H3/b12-6+
InChIKey LKHFLSRVMROKPI-WUXMJOGZSA-N
Mol Weight 287.4 g/mol
Molecular Formula C18H25NO2
Exact Mass 287.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8jaZe2K53P0
Name Benzene, [1-methyl-5-(2-nitrocyclohexyl)-4-pentenyl]-
Alternate Name(s) 1-(1-Nitrocyclohex-2-yl)-5-phenyl-1-hexene [(4E)-1-methyl-5-(2-nitrocyclohexyl)-4-pentenyl]benzene
CAS Registry Number 119729-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO2
InChI InChI=1S/C18H25NO2/c1-15(16-10-3-2-4-11-16)9-5-6-12-17-13-7-8-14-18(17)19(20)21/h2-4,6,10-12,15,17-18H,5,7-9,13-14H2,1H3/b12-6+
InChIKey LKHFLSRVMROKPI-WUXMJOGZSA-N
Molecular Weight 287.403 g/mol
SMILES C1(N(=O)=O)C(\C=C\CCC(c2ccccc2)C)CCCC1
SPLASH splash10-0a4l-1940000000-569617529bfb210eb050
Source of Spectrum F-43-5415-3
Wiley ID 1290984