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(-)-(1S,3aS,4S,7aS)-1-tert-Butoxy4-{(Z)-2-[2,5-dibromo-4-(2,2-dibromovinyl)phenyl]vinyl}-7a-methyl-2,3,3a,4,7,7a-hexahydro-1H-indene

View entire compound with spectra: 1 MS (GC)

(-)-(1S,3aS,4S,7aS)-1-tert-Butoxy4-{(Z)-2-[2,5-dibromo-4-(2,2-dibromovinyl)phenyl]vinyl}-7a-methyl-2,3,3a,4,7,7a-hexahydro-1H-indene
SpectraBase Compound ID KzCla36Li3R
InChI InChI=1S/C24H28Br4O/c1-23(2,3)29-21-10-9-18-15(6-5-11-24(18,21)4)7-8-16-12-20(26)17(13-19(16)25)14-22(27)28/h5-8,12-15,18,21H,9-11H2,1-4H3/b8-7-/t15-,18-,21-,24-/m0/s1
InChIKey VCHPCUHYWMVCLH-QHKORHDVSA-N
Mol Weight 652.1 g/mol
Molecular Formula C24H28Br4O
Exact Mass 647.887368 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35jY7qVKVYG
Name (-)-(1S,3aS,4S,7aS)-1-tert-Butoxy4-{(Z)-2-[2,5-dibromo-4-(2,2-dibromovinyl)phenyl]vinyl}-7a-methyl-2,3,3a,4,7,7a-hexahydro-1H-indene
Alternate Name(s) (6Z,17beta)-1,4-dibromo-17-tert-butoxy-2-(2,2-dibromovinyl)-9,10-secoestra-1,3,5(10),6,9-pentaene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28Br4O
InChI InChI=1S/C24H28Br4O/c1-23(2,3)29-21-10-9-18-15(6-5-11-24(18,21)4)7-8-16-12-20(26)17(13-19(16)25)14-22(27)28/h5-8,12-15,18,21H,9-11H2,1-4H3/b8-7-/t15-,18-,21-,24-/m0/s1
InChIKey VCHPCUHYWMVCLH-QHKORHDVSA-N
Molecular Weight 652.103 g/mol
SMILES [C@]12([C@@](CC[C@@]2(OC(C)(C)C)[H])([C@](\C=C/c2c(cc(c(c2)Br)C=C(Br)Br)Br)(C=CC1)[H])[H])C
SPLASH splash10-0a4i-9000000000-b92ded44c8fd2fd88006
Source of Spectrum QE-8-2121-13
Wiley ID 1557603