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(3S,4R)-3-[(E)-2-methyl-1-phenyl-but-1-enyl]-4-propan-2-yl-cyclohexan-1-one
SpectraBase Compound ID EZSrF9NI9z2
InChI InChI=1S/C20H28O/c1-5-15(4)20(16-9-7-6-8-10-16)19-13-17(21)11-12-18(19)14(2)3/h6-10,14,18-19H,5,11-13H2,1-4H3/b20-15-/t18-,19+/m1/s1
InChIKey MZKDUEJMQHEPPM-XKUXXELXSA-N
Mol Weight 284.44 g/mol
Molecular Formula C20H28O
Exact Mass 284.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zveIoOTQGz
Name (3S,4R)-3-[(E)-2-methyl-1-phenyl-but-1-enyl]-4-propan-2-yl-cyclohexan-1-one
Alternate Name(s) (3S,4R)-3-[(E)-2-methyl-1-phenylbut-1-enyl]-4-propan-2-yl-1-cyclohexanone (3S,4R)-4-isopropyl-3-[(E)-2-methyl-1-phenyl-but-1-enyl]cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O
InChI InChI=1S/C20H28O/c1-5-15(4)20(16-9-7-6-8-10-16)19-13-17(21)11-12-18(19)14(2)3/h6-10,14,18-19H,5,11-13H2,1-4H3/b20-15-/t18-,19+/m1/s1
InChIKey MZKDUEJMQHEPPM-XKUXXELXSA-N
Molecular Weight 284.443 g/mol
SMILES [C@]1(\C(=C/(CC)C)c2ccccc2)([C@](CCC(C1)=O)(C(C)C)[H])[H]
SPLASH splash10-05po-2910000000-5a16a50920413738cdbc
Source of Spectrum F-51-4414-6
Wiley ID 791574