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cis-3,4,4a,11,12,12a-Hexahydro-8-methoxy-4a-methyl-2(1h)-chrysenone

View entire compound with spectra: 1 FTIR

cis-3,4,4a,11,12,12a-Hexahydro-8-methoxy-4a-methyl-2(1h)-chrysenone
SpectraBase Compound ID HLwGF6FwChk
InChI InChI=1S/C20H22O2/c1-20-10-9-15(21)12-14(20)4-6-18-17-7-5-16(22-2)11-13(17)3-8-19(18)20/h3,5,7-8,11,14H,4,6,9-10,12H2,1-2H3/t14-,20+/s2
InChIKey TXIIVFDKXLQMPI-CDESSEEXSA-N
Mol Weight 294.39 g/mol
Molecular Formula C20H22O2
Exact Mass 294.16198 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LJw8BvCxdTh
Name cis-3,4,4a,11,12,12a-Hexahydro-8-methoxy-4a-methyl-2(1h)-chrysenone
Source of Sample J. P. Kutney, the University of British Columbia, Vancouver, Canada
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O2
InChI InChI=1S/C20H22O2/c1-20-10-9-15(21)12-14(20)4-6-18-17-7-5-16(22-2)11-13(17)3-8-19(18)20/h3,5,7-8,11,14H,4,6,9-10,12H2,1-2H3/t14-,20+/s2
InChIKey TXIIVFDKXLQMPI-CDESSEEXSA-N
Literature Reference Abstract-Chemical Abstracts= 60, 10617(1964)
Melting Point 155-155.5C
Molecular Weight 294.394000
SMILES C[C@]12[C@](CCc3c1ccc1c3ccc(c1)OC)(CC(CC2)=O)[H]
Technique KBr WAFER