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(1S,2S,3'aR,5R,6'aS)-3'a,6'a-Dihydro-2-isopropyl-5-methyl-3'a-phenoxy-5'-phenylspiro[cyclohexane-1,2'-[4H]cyclopenta[1,3]dioxole]

View entire compound with spectra: 1 MS (GC)

(1S,2S,3'aR,5R,6'aS)-3'a,6'a-Dihydro-2-isopropyl-5-methyl-3'a-phenoxy-5'-phenylspiro[cyclohexane-1,2'-[4H]cyclopenta[1,3]dioxole]
SpectraBase Compound ID D0yTw7EhNeK
InChI InChI=1S/C27H32O3/c1-19(2)24-15-14-20(3)17-26(24)29-25-16-22(21-10-6-4-7-11-21)18-27(25,30-26)28-23-12-8-5-9-13-23/h4-13,16,19-20,24-25H,14-15,17-18H2,1-3H3/t20-,24+,25+,26+,27-/m1/s1
InChIKey DDCMNRIOOSLAGK-LUNJLAKLSA-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 B01DDK5UR84
Name (1S,2S,3'aR,5R,6'aS)-3'a,6'a-Dihydro-2-isopropyl-5-methyl-3'a-phenoxy-5'-phenylspiro[cyclohexane-1,2'-[4H]cyclopenta[1,3]dioxole]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32O3
InChI InChI=1S/C27H32O3/c1-19(2)24-15-14-20(3)17-26(24)29-25-16-22(21-10-6-4-7-11-21)18-27(25,30-26)28-23-12-8-5-9-13-23/h4-13,16,19-20,24-25H,14-15,17-18H2,1-3H3/t20-,24+,25+,26+,27-/m1/s1
InChIKey DDCMNRIOOSLAGK-LUNJLAKLSA-N
Molecular Weight 404.550 g/mol
SMILES [C@@]12(O[C@@]3([C@@](CC[C@](C3)(C)[H])(C(C)C)[H])O[C@]1(C=C(C2)c1ccccc1)[H])Oc1ccccc1
SPLASH splash10-0pb9-0972000000-35f888ba5c30bd69a686
Source of Spectrum H-20-2451-13
Synonyms (1S,2S,3'aR,5R,6'aS)-5-methyl-3'a-phenoxy-5'-phenyl-2-(propan-2-yl)-4',6'a-dihydro-3'aH-spiro[cyclohexane-1,2'-cyclopenta[d][1,3]dioxole]
Wiley ID 1371563