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(-)-(1S,3aS,4S,7aS)-1-tert-Butoxy-4[(Z)-2-[2,4-dibromo-5-([1,3]dioxolan-2-yl)phenyl]vinyl}-7-methyl-2,3,3a,4,7,7a-hexahydro-1H-indene

View entire compound with spectra: 1 MS (GC)

(-)-(1S,3aS,4S,7aS)-1-tert-Butoxy-4[(Z)-2-[2,4-dibromo-5-([1,3]dioxolan-2-yl)phenyl]vinyl}-7-methyl-2,3,3a,4,7,7a-hexahydro-1H-indene
SpectraBase Compound ID E2en1jGq9rU
InChI InChI=1S/C25H32Br2O3/c1-24(2,3)30-22-10-9-19-16(6-5-11-25(19,22)4)7-8-17-14-18(21(27)15-20(17)26)23-28-12-13-29-23/h5-8,14-16,19,22-23H,9-13H2,1-4H3/b8-7-/t16-,19-,22-,25-/m0/s1
InChIKey DJXKWLCHCCNKKU-YRZRVLTJSA-N
Mol Weight 540.3 g/mol
Molecular Formula C25H32Br2O3
Exact Mass 538.071821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4V7cotJ9eDH
Name (-)-(1S,3aS,4S,7aS)-1-tert-Butoxy-4[(Z)-2-[2,4-dibromo-5-([1,3]dioxolan-2-yl)phenyl]vinyl}-7-methyl-2,3,3a,4,7,7a-hexahydro-1H-indene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H32Br2O3
InChI InChI=1S/C25H32Br2O3/c1-24(2,3)30-22-10-9-19-16(6-5-11-25(19,22)4)7-8-17-14-18(21(27)15-20(17)26)23-28-12-13-29-23/h5-8,14-16,19,22-23H,9-13H2,1-4H3/b8-7-/t16-,19-,22-,25-/m0/s1
InChIKey DJXKWLCHCCNKKU-YRZRVLTJSA-N
Molecular Weight 540.336 g/mol
SMILES c1(c(cc(c(c1)\C=C/[C@]1([C@]2([C@]([C@@](OC(C)(C)C)(CC2)[H])(C)CC=C1)[H])[H])Br)Br)C1OCCO1
SPLASH splash10-0uk9-3000900000-a1fefdf9dcf35d20edd5
Source of Spectrum QE-8-2122-26
Wiley ID 1557590