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3-[(T-Butyldimethylsilyl)oxy]-4-(BENZYLOXY0-6-[7''-(methoxycarbonyl)-5''-methylhepta-1'',6''-dien-1''-ylidene)-3,4,5,6-tetrahydrobenzaldehyde

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

3-[(T-Butyldimethylsilyl)oxy]-4-(BENZYLOXY0-6-[7''-(methoxycarbonyl)-5''-methylhepta-1'',6''-dien-1''-ylidene)-3,4,5,6-tetrahydrobenzaldehyde
SpectraBase Compound ID DxP3jJrRcMB
InChI InChI=1S/C40H48O5Si/c1-31(25-26-39(42)43-5)17-15-16-20-33-27-37(44-30-32-18-9-6-10-19-32)38(28-34(33)29-41)45-46(40(2,3)4,35-21-11-7-12-22-35)36-23-13-8-14-24-36/h6-14,18-26,28-29,31,37-38H,15-17,27,30H2,1-5H3/b26-25-,33-20+/t31?,37-,38+/m1/s1
InChIKey UZAUAUSMEGTNKH-UNONPJOMSA-N
Mol Weight 636.9 g/mol
Molecular Formula C40H48O5Si
Exact Mass 636.327101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E5KtUykdet
Name 3-[(T-Butyldimethylsilyl)oxy]-4-(BENZYLOXY0-6-[7''-(methoxycarbonyl)-5''-methylhepta-1'',6''-dien-1''-ylidene)-3,4,5,6-tetrahydrobenzaldehyde
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 636.327101176 u
Formula C40H48O5Si
InChI InChI=1S/C40H48O5Si/c1-31(25-26-39(42)43-5)17-15-16-20-33-27-37(44-30-32-18-9-6-10-19-32)38(28-34(33)29-41)45-46(40(2,3)4,35-21-11-7-12-22-35)36-23-13-8-14-24-36/h6-14,18-26,28-29,31,37-38H,15-17,27,30H2,1-5H3/b26-25-,33-20+/t31?,37-,38+/m1/s1
InChIKey UZAUAUSMEGTNKH-UNONPJOMSA-N
Molecular Weight 636.904 g/mol
SMILES [C@@]1(O[Si](C(C)(C)C)(C2=CC=CC=C2)C=2C=CC=CC2)(C=C(C=O)\C(C[C@]1(OCC1=CC=CC=C1)[H])=C\CCCC(\C=C/C(=O)OC)C)[H]