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(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]

View entire compound with spectra: 1 MS (GC)

(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]
SpectraBase Compound ID 9e1npkAXBaj
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/t20?,24?,25-,26-,27?/m1/s1
InChIKey NCBAHDIWMQIGPU-BGYAUZGDSA-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 50uKulA6YrW
Name (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]
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)17-27(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/t20?,24?,25-,26-,27?/m1/s1
InChIKey NCBAHDIWMQIGPU-BGYAUZGDSA-N
Molecular Weight 404.550 g/mol
SMILES C12(O[C@@]3(C=C(c4ccccc4)C[C@@]3(OO1)c1ccccc1)[H])C(CCC(C2)C)C(C)C
SPLASH splash10-0a4i-9810000000-dbe8853c3f925b8ef23e
Source of Spectrum H-20-2451-11
Synonyms (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] 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]
Wiley ID 1371565