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Copalic acid 1-acetyl-3-(tert-butyldimethylsilyl)glycerol ester
SpectraBase Compound ID D1bniTlxpwt
InChI InChI=1S/C29H52O4Si/c1-21(18-26(31)32-19-23(30)20-33-34(9,10)27(3,4)5)12-14-24-22(2)13-15-25-28(6,7)16-11-17-29(24,25)8/h18,23-25,30H,2,11-17,19-20H2,1,3-10H3/b21-18+/t23?,24-,25?,29+/m1/s1
InChIKey QPVFIBVPUPBNGE-JBGPSUNBSA-N
Mol Weight 492.8 g/mol
Molecular Formula C29H52O4Si
Exact Mass 492.363487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ItHkvFLKdyt
Name Copalic acid 1-acetyl-3-(tert-butyldimethylsilyl)glycerol ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H52O4Si
InChI InChI=1S/C29H52O4Si/c1-21(18-26(31)32-19-23(30)20-33-34(9,10)27(3,4)5)12-14-24-22(2)13-15-25-28(6,7)16-11-17-29(24,25)8/h18,23-25,30H,2,11-17,19-20H2,1,3-10H3/b21-18+/t23?,24-,25?,29+/m1/s1
InChIKey QPVFIBVPUPBNGE-JBGPSUNBSA-N
Molecular Weight 492.816 g/mol
SMILES OC(CO[Si](C(C)(C)C)(C)C)COC(\C=C\(CC[C@]1([C@]2(C(C(CCC2)(C)C)CCC1=C)C)[H])C)=O
SPLASH splash10-05n0-3190000000-c436be196df7c72f54ee
Source of Spectrum F-56-2511-1
Wiley ID 856611