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2-Isopropyl-5-methylcyclohexyl 2'-(1''-naphthyl)-2'-phenylethanoate
SpectraBase Compound ID B0Bdot43wMJ
InChI InChI=1S/C28H32O2/c1-19(2)23-17-16-20(3)18-26(23)30-28(29)27(22-11-5-4-6-12-22)25-15-9-13-21-10-7-8-14-24(21)25/h4-15,19-20,23,26-27H,16-18H2,1-3H3
InChIKey CROKEFGGSRURET-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C28H32O2
Exact Mass 400.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3VlOmsIS5A
Name 2-Isopropyl-5-methylcyclohexyl 2'-(1''-naphthyl)-2'-phenylethanoate
Alternate Name(s) 2-isopropyl-5-methylcyclohexyl 1-naphthyl(phenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32O2
InChI InChI=1S/C28H32O2/c1-19(2)23-17-16-20(3)18-26(23)30-28(29)27(22-11-5-4-6-12-22)25-15-9-13-21-10-7-8-14-24(21)25/h4-15,19-20,23,26-27H,16-18H2,1-3H3
InChIKey CROKEFGGSRURET-UHFFFAOYSA-N
Molecular Weight 400.562 g/mol
SMILES C(C(c1c2c(cccc2)ccc1)c1ccccc1)(OC1C(CCC(C1)C)C(C)C)=O
SPLASH splash10-0159-9180100000-53fec2eb5f8d4bd2dd23
Source of Spectrum D1-2002-1887-1
Wiley ID 1548207