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(E)-((1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl) 3-p-tolylacrylate
SpectraBase Compound ID B82UCKGArBn
InChI InChI=1S/C20H28O2/c1-14(2)18-11-7-16(4)13-19(18)22-20(21)12-10-17-8-5-15(3)6-9-17/h5-6,8-10,12,14,16,18-19H,7,11,13H2,1-4H3/b12-10+/t16-,18+,19-/m0/s1
InChIKey BHEWPIXEHSRDCW-UQBQMVFPSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DzaoYUv1nRs
Name (E)-((1S,2R,5S)-2-Isopropyl-5-methylcyclohexyl) 3-p-tolylacrylate
Alternate Name(s) (1S,2R,5S)-2-isopropyl-5-methylcyclohexyl (E)-3-(p-tolyl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-14(2)18-11-7-16(4)13-19(18)22-20(21)12-10-17-8-5-15(3)6-9-17/h5-6,8-10,12,14,16,18-19H,7,11,13H2,1-4H3/b12-10+/t16-,18+,19-/m0/s1
InChIKey BHEWPIXEHSRDCW-UQBQMVFPSA-N
Literature Reference DOI 10.1002/ajoc.201600591
Molecular Weight 300.442 g/mol
SMILES C(\C=C\c1ccc(cc1)C)(=O)O[C@@]1([C@](CC[C@@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-000g-2900000000-df6f23959a7ce69c837f
Source of Spectrum AJO-6-311-34
Wiley ID 1806291