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3-Benzyloxy-1-((1R,2S)-2,6,6-trimethyl-cyclohex-3-enyl)-butan-1-one
SpectraBase Compound ID 64vjy0uckdO
InChI InChI=1S/C20H28O2/c1-15-9-8-12-20(3,4)19(15)18(21)13-16(2)22-14-17-10-6-5-7-11-17/h5-11,15-16,19H,12-14H2,1-4H3/t15-,16?,19-/m0/s1
InChIKey XZARRQPYTMPYAL-QLYZIHHJSA-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 Caqyxjcw1DN
Name 3-Benzyloxy-1-((1R,2S)-2,6,6-trimethyl-cyclohex-3-enyl)-butan-1-one
Alternate Name(s) 3-(Benzyloxy)-1-(2',6',6'-trimethylcyclohex-2'-en-1'-yl)-butan-1-one 3-(benzyloxy)-1-[(1R,2S)-2,6,6-trimethyl-3-cyclohexen-1-yl]-1-butanone
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Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-15-9-8-12-20(3,4)19(15)18(21)13-16(2)22-14-17-10-6-5-7-11-17/h5-11,15-16,19H,12-14H2,1-4H3/t15-,16?,19-/m0/s1
InChIKey XZARRQPYTMPYAL-QLYZIHHJSA-N
Molecular Weight 300.442 g/mol
SMILES C([C@]1(C(CC=C[C@@]1(C)[H])(C)C)[H])(CC(OCc1ccccc1)C)=O
SPLASH splash10-0006-9500000000-e5c9b09bc459a624c7a3
Source of Spectrum C-88-3134-10
Wiley ID 1590540