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(1'E,6'Z)-(1S,2R,3'S,4'S,1''R)-1-(5'-Tert-butyldimethylsilyloxy-1'-tert-butyldiphenylsiloxypentyl)-2-(3',4'-dihydroxy-3',4'-o-isopropylideneundec-1',6'-dienyl)cyclopropane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1'E,6'Z)-(1S,2R,3'S,4'S,1''R)-1-(5'-Tert-butyldimethylsilyloxy-1'-tert-butyldiphenylsiloxypentyl)-2-(3',4'-dihydroxy-3',4'-o-isopropylideneundec-1',6'-dienyl)cyclopropane
SpectraBase Compound ID 7aRfdiPsxEK
InChI InChI=1S/C45H72O4Si2/c1-12-13-14-15-16-23-31-41-42(48-45(8,9)47-41)33-32-36-35-39(36)40(30-24-25-34-46-50(10,11)43(2,3)4)49-51(44(5,6)7,37-26-19-17-20-27-37)38-28-21-18-22-29-38/h16-23,26-29,32-33,36,39-42H,12-15,24-25,30-31,34-35H2,1-11H3/b23-16-,33-32+/t36-,39-,40+,41-,42+/m0/s1
InChIKey JFEWOPBQSMJGMY-MQJNSTNYSA-N
Mol Weight 733.2 g/mol
Molecular Formula C45H72O4Si2
Exact Mass 732.496914 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tM7V4ZEfwL
Name (1'E,6'Z)-(1S,2R,3'S,4'S,1''R)-1-(5'-Tert-butyldimethylsilyloxy-1'-tert-butyldiphenylsiloxypentyl)-2-(3',4'-dihydroxy-3',4'-o-isopropylideneundec-1',6'-dienyl)cyclopropane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 732.496913864 u
Formula C45H72O4Si2
InChI InChI=1S/C45H72O4Si2/c1-12-13-14-15-16-23-31-41-42(48-45(8,9)47-41)33-32-36-35-39(36)40(30-24-25-34-46-50(10,11)43(2,3)4)49-51(44(5,6)7,37-26-19-17-20-27-37)38-28-21-18-22-29-38/h16-23,26-29,32-33,36,39-42H,12-15,24-25,30-31,34-35H2,1-11H3/b23-16-,33-32+/t36-,39-,40+,41-,42+/m0/s1
InChIKey JFEWOPBQSMJGMY-MQJNSTNYSA-N
Molecular Weight 733.237 g/mol
SMILES [C@@]1([C@](\C=C\[C@]2(OC(C)(C)O[C@]2(C\C=C/CCCCC)[H])[H])([H])C1)([C@](O[Si](C(C)(C)C)(C1=CC=CC=C1)C1=CC=CC=C1)(CCCCO[Si](C(C)(C)C)(C)C)[H])[H]