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(1R,2S,4'aR,5R,7R)-4',7'a-Dihydro-2-isopropyl-5-methyl-6',7'a-diphenylspiro[cyclohexane-1',3'-[7'H]cyclopenta[1,2,4]trioxine]
SpectraBase Compound ID 2bVwCiTnJQY
InChI InChI=1S/C27H32O3/c1-19(2)24-15-14-20(3)17-27(24)28-25-16-22(21-10-6-4-7-11-21)18-26(25,29-30-27)23-12-8-5-9-13-23/h4-13,16,19-20,24-25H,14-15,17-18H2,1-3H3
InChIKey NCBAHDIWMQIGPU-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C27H32O3
Exact Mass 404.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92sk80obPLN
Name (1R,2S,4'aR,5R,7R)-4',7'a-Dihydro-2-isopropyl-5-methyl-6',7'a-diphenylspiro[cyclohexane-1',3'-[7'H]cyclopenta[1,2,4]trioxine]
Alternate Name(s) (1S,2S,5R,4'aS,7'aS)-4',7'a-Dihydro-2-isopropyl-5-methyl-6',7'a-diphenylspiro[cyclohexane-1',3'-[7'H]cyclopenta[1,2,4]trioxine] 5-Methyl-4'a,6'-diphenyl-2-(propan-2-yl)-5',7'a-dihydro-4'aH-spiro[cyclohexane-1,2'-cyclopenta[e][1,2,4]trioxine]
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Formula C27H32O3
InChI InChI=1S/C27H32O3/c1-19(2)24-15-14-20(3)17-27(24)28-25-16-22(21-10-6-4-7-11-21)18-26(25,29-30-27)23-12-8-5-9-13-23/h4-13,16,19-20,24-25H,14-15,17-18H2,1-3H3
InChIKey NCBAHDIWMQIGPU-UHFFFAOYSA-N
Molecular Weight 404.550 g/mol
SMILES C12(OC3C=C(c4ccccc4)CC3(OO1)c1ccccc1)C(CCC(C2)C)C(C)C
SPLASH splash10-0a59-3980000000-1cea15183d497240f408
Source of Spectrum H-20-2451-12
Wiley ID 1371564