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11H-Cycloundeca[1,2-b:5,6-b']bis[1]benzopyran, 5a,6,9,10,10a,16a,17,18,18a,19-decahydro-5a,9,9,16a-tetramethyl-, [5aR-(5aR*,10aS*,16aR*,18aS*)]-

View entire compound with spectra: 1 MS (GC)

11H-Cycloundeca[1,2-b:5,6-b']bis[1]benzopyran, 5a,6,9,10,10a,16a,17,18,18a,19-decahydro-5a,9,9,16a-tetramethyl-, [5aR-(5aR*,10aS*,16aR*,18aS*)]-
SpectraBase Compound ID 5OkWVtobH1h
InChI InChI=1S/C29H36O2/c1-27(2)15-9-16-28(3)23(18-21-10-5-7-12-25(21)30-28)14-17-29(4)24(20-27)19-22-11-6-8-13-26(22)31-29/h5-13,15,23-24H,14,16-20H2,1-4H3/b15-9+/t23-,24+,28+,29+/m0/s1
InChIKey ISSPUSZYYOWQJE-LBGGBEFWSA-N
Mol Weight 416.6 g/mol
Molecular Formula C29H36O2
Exact Mass 416.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4LLS2aOIJQv
Name 11H-Cycloundeca[1,2-b:5,6-b']bis[1]benzopyran, 5a,6,9,10,10a,16a,17,18,18a,19-decahydro-5a,9,9,16a-tetramethyl-, [5aR-(5aR*,10aS*,16aR*,18aS*)]-
CAS Registry Number 128216-79-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H36O2
InChI InChI=1S/C29H36O2/c1-27(2)15-9-16-28(3)23(18-21-10-5-7-12-25(21)30-28)14-17-29(4)24(20-27)19-22-11-6-8-13-26(22)31-29/h5-13,15,23-24H,14,16-20H2,1-4H3/b15-9+/t23-,24+,28+,29+/m0/s1
InChIKey ISSPUSZYYOWQJE-LBGGBEFWSA-N
Molecular Weight 416.605 g/mol
SMILES [C@]12(Oc3ccccc3C[C@@]2(CC(\C=C\C[C@]2(Oc3c(C[C@@]2(CC1)[H])cccc3)C)(C)C)[H])C
SPLASH splash10-0a4i-0901100000-ba00ebf07dd0b2f0c3bc
Source of Spectrum J-55-5109-0
Synonyms (5a,6,9,10,10a,16a,17,18,18a,19-Decahydro-4a,9,9,16a-tetramethyl-11H-cycloundeca[1,2-b:5,6-b']bis[1]-benzopyran)
Wiley ID 1376690