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(3R,6R)-3-[(1S,3R,4R)-4-ethenyl-4-methyl-3-(1-methylethenyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)-2-oxanone
SpectraBase Compound ID GszF2TCnlIQ
InChI InChI=1S/C20H32O3/c1-7-20(6)11-10-14(12-16(20)13(2)3)15-8-9-17(19(4,5)22)23-18(15)21/h7,14-17,22H,1-2,8-12H2,3-6H3/t14-,15+,16+,17+,20-/m0/s1
InChIKey JXAJTJLMMBAZIN-HRJHHYPFSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qrQR2RkEqO
Name (3R,6R)-3-[(1S,3R,4R)-4-ethenyl-4-methyl-3-(1-methylethenyl)cyclohexyl]-6-(2-hydroxypropan-2-yl)-2-oxanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-7-20(6)11-10-14(12-16(20)13(2)3)15-8-9-17(19(4,5)22)23-18(15)21/h7,14-17,22H,1-2,8-12H2,3-6H3/t14-,15+,16+,17+,20-/m0/s1
InChIKey JXAJTJLMMBAZIN-HRJHHYPFSA-N
Molecular Weight 320.473 g/mol
SMILES OC([C@@]1(OC([C@@]([C@@]2(C[C@@](C(=C)C)([H])[C@](CC2)(C=C)C)[H])(CC1)[H])=O)[H])(C)C
SPLASH splash10-08fr-0900000000-5085b35eb4442376216d
Source of Spectrum KC-0-786-31
Synonyms (3R,6R)-3-[(1S,3R,4R)-4-ethenyl-4-methyl-3-prop-1-en-2-yl-cyclohexyl]-6-(2-oxidanylpropan-2-yl)oxan-2-one (3R,6R)-3-[(1S,3R,4R)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]-6-(2-hydroxypropan-2-yl)oxan-2-one (3R,6R)-6-(1-hydroxy-1-methyl-ethyl)-3-[(1S,3R,4R)-3-isopropenyl-4-methyl-4-vinyl-cyclohexyl]tetrahydropyran-2-one
Wiley ID 827686