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1,7-Dioxaspiro[5.5]undecan-4-ol, 2-[6-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-3,5-dimethyl-2-hexenyl]-8,9-dimethyl-, benzoate, [2R-[2.alpha.(2E,5R*),4.alpha.,6.beta.(8R*,9S*)]]-

View entire compound with spectra: 1 MS (GC)

1,7-Dioxaspiro[5.5]undecan-4-ol, 2-[6-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-3,5-dimethyl-2-hexenyl]-8,9-dimethyl-, benzoate, [2R-[2.alpha.(2E,5R*),4.alpha.,6.beta.(8R*,9S*)]]-
SpectraBase Compound ID EbMBbep3Q09
InChI InChI=1S/C42H56O5Si/c1-31(27-32(2)30-44-48(41(5,6)7,38-19-13-9-14-20-38)39-21-15-10-16-22-39)23-24-36-28-37(45-40(43)35-17-11-8-12-18-35)29-42(47-36)26-25-33(3)34(4)46-42/h8-23,32-34,36-37H,24-30H2,1-7H3/b31-23+/t32-,33+,34-,36-,37+,42+/m1/s1
InChIKey QNSNVYCJHIVEOE-ZHJYBKAUSA-N
Mol Weight 669.0 g/mol
Molecular Formula C42H56O5Si
Exact Mass 668.389701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ej8KImsWLK
Name 1,7-Dioxaspiro[5.5]undecan-4-ol, 2-[6-[[(1,1-dimethylethyl)diphenylsilyl]oxy]-3,5-dimethyl-2-hexenyl]-8,9-dimethyl-, benzoate, [2R-[2.alpha.(2E,5R*),4.alpha.,6.beta.(8R*,9S*)]]-
CAS Registry Number 127785-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H56O5Si
InChI InChI=1S/C42H56O5Si/c1-31(27-32(2)30-44-48(41(5,6)7,38-19-13-9-14-20-38)39-21-15-10-16-22-39)23-24-36-28-37(45-40(43)35-17-11-8-12-18-35)29-42(47-36)26-25-33(3)34(4)46-42/h8-23,32-34,36-37H,24-30H2,1-7H3/b31-23+/t32-,33+,34-,36-,37+,42+/m1/s1
InChIKey QNSNVYCJHIVEOE-ZHJYBKAUSA-N
Molecular Weight 668.990 g/mol
SMILES [C@@]12(O[C@](C)([C@](CC2)(C)[H])[H])O[C@](C\C=C\(C[C@](CO[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)(C)[H])C)(C[C@@](C1)(OC(=O)c1ccccc1)[H])[H]
SPLASH splash10-0a4i-0901100000-e5b0bf7ac91619a87e5f
Source of Spectrum F-45-7185-35
Synonyms (+)-[2r(2E,4R)4S,6S,8R,9S]-2-[6-(tert-butyldiphenylsilyloxy)-3,5-dimethyl-2-hexenyl]-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-4-ol (2R,4S,6R,8R,9S)-2-((2E,5R)-6-{[tert-butyl(diphenyl)silyl]oxy}-3,5-dimethyl-2-hexenyl)-8,9-dimethyl-1,7-dioxaspiro[5.5]undec-4-yl benzoate benzoic acid[(3S,4R,6R,8S,10R)-10-[(E,5R)-6-[tert-butyl(diphenyl)silyl]oxy-3,5-dimethyl-hex-2-enyl]-3,4-dimethyl-5,11-dioxaspiro[5.5]undecan-8-yl]ester [(3S,4R,6R,8S,10R)-10-[(E,5R)-6-[tert-butyl(diphenyl)silyl]oxy-3,5-dimethyl-hex-2-enyl]-3,4-dimethyl-5,11-dioxaspiro[5.5]undecan-8-yl]benzoate benzoic acid [(2R,4S,6R,8R,9S)-2-[(E,5R)-6-[tert-butyl(diphenyl)silyl]oxy-3,5-dimethylhex-2-enyl]-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-4-yl] ester [(2R,4S,6R,8R,9S)-2-[(E,5R)-6-[tert-butyl(diphenyl)silyl]oxy-3,5-dimethylhex-2-enyl]-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-4-yl] benzoate [(2R,4S,6R,8R,9S)-2-[(E,5R)-6-[tert-butyl(diphenyl)silyl]oxy-3,5-dimethyl-hex-2-enyl]-8,9-dimethyl-1,7-dioxaspiro[5.5]undecan-4-yl] benzoate
Wiley ID 1413871