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2-(Cyclohexyl)-3-(p-tolyl)-1-oxo-2,3,4,5,6,7-hexahydro-1H-isoindole
SpectraBase Compound ID Bnf98sFcwna
InChI InChI=1S/C21H27NO/c1-15-11-13-16(14-12-15)20-18-9-5-6-10-19(18)21(23)22(20)17-7-3-2-4-8-17/h11-14,17,20H,2-10H2,1H3
InChIKey XVBLLYXDCAPDMV-UHFFFAOYSA-N
Mol Weight 309.45 g/mol
Molecular Formula C21H27NO
Exact Mass 309.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8dHDh3C7Mo9
Name 2-(Cyclohexyl)-3-(p-tolyl)-1-oxo-2,3,4,5,6,7-hexahydro-1H-isoindole
Alternate Name(s) 2-cyclohexyl-3-(4-methylphenyl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO
InChI InChI=1S/C21H27NO/c1-15-11-13-16(14-12-15)20-18-9-5-6-10-19(18)21(23)22(20)17-7-3-2-4-8-17/h11-14,17,20H,2-10H2,1H3
InChIKey XVBLLYXDCAPDMV-UHFFFAOYSA-N
Molecular Weight 309.453 g/mol
SMILES C1(N(C(C=2CCCCC12)c1ccc(cc1)C)C1CCCCC1)=O
SPLASH splash10-0ar0-0096000000-90b3f846f9decfa6b581
Source of Spectrum H1-36-1820-2
Wiley ID 755260