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1,2-diphenylethyl (4S)-4-(prop-1-en-2-yl)cyclohex-1-ene-1-carboxylate
SpectraBase Compound ID DAqFiXloqCU
InChI InChI=1S/C24H26O2/c1-18(2)20-13-15-22(16-14-20)24(25)26-23(21-11-7-4-8-12-21)17-19-9-5-3-6-10-19/h3-12,15,20,23H,1,13-14,16-17H2,2H3/t20-,23?/m1/s1
InChIKey NQJZUCFIACWZMJ-PPUHSXQSSA-N
Mol Weight 346.47 g/mol
Molecular Formula C24H26O2
Exact Mass 346.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wOacXUW8yi
Name 1,2-diphenylethyl (4S)-4-(prop-1-en-2-yl)cyclohex-1-ene-1-carboxylate
Appearance Ccolorless oil
Carrier Gas Methane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.193280075 u
Formula C24H26O2
InChI InChI=1S/C24H26O2/c1-18(2)20-13-15-22(16-14-20)24(25)26-23(21-11-7-4-8-12-21)17-19-9-5-3-6-10-19/h3-12,15,20,23H,1,13-14,16-17H2,2H3/t20-,23?/m1/s1
InChIKey NQJZUCFIACWZMJ-PPUHSXQSSA-N
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/chem.202201761
Molecular Weight 346.470 g/mol
Quality 179
Reported Formula C24H26O2
SMILES C1(=CC=CC=C1)CC(C1=CC=CC=C1)OC(=O)C1=CC[C@](CC1)(C(=C)C)[H]
SPLASH splash10-05oy-9810000000-d766b3a30b0ffa8c0243
Source of Spectrum QE-28-SM20-3r (DOI: 10.1002/chem.202201761)
Thin-Layer Chromatography 0.34 (n-pentane/EtOAc, 20:1)
Wiley ID 1900693