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15-Hydroxy-7-oxodehydroabieticacid,trimethylsilyl ester,15-trimethylsilyl ether
SpectraBase Compound ID 9SyIOofiIyu
InChI InChI=1S/C26H42O4Si2/c1-24(2,30-32(8,9)10)18-12-13-20-19(16-18)21(27)17-22-25(20,3)14-11-15-26(22,4)23(28)29-31(5,6)7/h12-13,16,22H,11,14-15,17H2,1-10H3/t22?,25-,26?/m1/s1
InChIKey BRUOBPCONYQJST-FZCDEOOCSA-N
Mol Weight 474.8 g/mol
Molecular Formula C26H42O4Si2
Exact Mass 474.262163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gz01XFuw13i
Name 15-Hydroxy-7-oxodehydroabieticacid,trimethylsilyl ester,15-trimethylsilyl ether
Classification Resin acid
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 474.262162898 u
Formula C26H42O4Si2
InChI InChI=1S/C26H42O4Si2/c1-24(2,30-32(8,9)10)18-12-13-20-19(16-18)21(27)17-22-25(20,3)14-11-15-26(22,4)23(28)29-31(5,6)7/h12-13,16,22H,11,14-15,17H2,1-10H3/t22?,25-,26?/m1/s1
InChIKey BRUOBPCONYQJST-FZCDEOOCSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 474.788 g/mol
Nominal Mass 474 u
Quality 990
Retention Index 3399
SMILES C12[C@@](C=3C(C(C2)=O)=CC(C(O[Si](C)(C)C)(C)C)=CC3)(CCCC1(C(O[Si](C)(C)C)=O)C)C
SPLASH splash10-0ab9-5422900000-fbc0b6d4c6682cf0af18
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (1R,4aS)-7-iso-Propyl-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid
Technique GC/MS
Wiley ID DD2024_018348