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2-[3-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-benzodioxol-5-yl]-1-cyclohex-2-enyl]acetic acid ethyl ester
SpectraBase Compound ID FCj0NhU7oqd
InChI InChI=1S/C24H36O5Si/c1-7-26-23(25)12-17-9-8-10-18(11-17)20-14-22-21(27-16-28-22)13-19(20)15-29-30(5,6)24(2,3)4/h11,13-14,17H,7-10,12,15-16H2,1-6H3
InChIKey ZIMOOOHKUWFZHO-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C24H36O5Si
Exact Mass 432.233201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BNipNC54O0R
Name 2-[3-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-benzodioxol-5-yl]-1-cyclohex-2-enyl]acetic acid ethyl ester
Comments Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 1382309 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O5Si
InChI InChI=1S/C24H36O5Si/c1-7-26-23(25)12-17-9-8-10-18(11-17)20-14-22-21(27-16-28-22)13-19(20)15-29-30(5,6)24(2,3)4/h11,13-14,17H,7-10,12,15-16H2,1-6H3
InChIKey ZIMOOOHKUWFZHO-UHFFFAOYSA-N
Molecular Weight 432.632 g/mol
SMILES c1(C2=CC(CC(=O)OCC)CCC2)c(cc2c(c1)OCO2)CO[Si](C(C)(C)C)(C)C
SPLASH splash10-03di-0091000000-773b96a7f62773340cb9
Source of Spectrum J-57-6786-12
Synonyms 2-[3-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-benzodioxol-5-yl]cyclohex-2-en-1-yl]acetic acid ethyl ester Ethyl 2-[3-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-benzodioxol-5-yl]cyclohex-2-en-1-yl]acetate Ethyl 2-[3-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-benzodioxol-5-yl]cyclohex-2-en-1-yl]ethanoate
Wiley ID 1821223