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3-Dibenzothiophenecarboxylic acid, 4-pentyl-2-(trimethylsilyl)-, ethyl ester

View entire compound with spectra: 1 MS (GC)

3-Dibenzothiophenecarboxylic acid, 4-pentyl-2-(trimethylsilyl)-, ethyl ester
SpectraBase Compound ID HKgzVYk29Th
InChI InChI=1S/C23H30O2SSi/c1-6-8-9-13-17-21(23(24)25-7-2)20(27(3,4)5)15-18-16-12-10-11-14-19(16)26-22(17)18/h10-12,14-15H,6-9,13H2,1-5H3
InChIKey PPYVCLLXUHTNMY-UHFFFAOYSA-N
Mol Weight 398.64 g/mol
Molecular Formula C23H30O2SSi
Exact Mass 398.173578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7oeV2i1cNyG
Name 3-Dibenzothiophenecarboxylic acid, 4-pentyl-2-(trimethylsilyl)-, ethyl ester
Alternate Name(s) Ethyl 1-pentyl-3-trimethyl-silyldibenzothiophene-2-carboxylate Ethyl 4-pentyl-2-(trimethylsilyl)dibenzo[b,d]thiophene-3-carboxylate
CAS Registry Number 128405-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O2SSi
InChI InChI=1S/C23H30O2SSi/c1-6-8-9-13-17-21(23(24)25-7-2)20(27(3,4)5)15-18-16-12-10-11-14-19(16)26-22(17)18/h10-12,14-15H,6-9,13H2,1-5H3
InChIKey PPYVCLLXUHTNMY-UHFFFAOYSA-N
Molecular Weight 398.636 g/mol
SMILES c12c(cc(c(c2CCCCC)C(=O)OCC)[Si](C)(C)C)c2ccccc2s1
SPLASH splash10-001i-0009000000-003e79fa97ffe18a6a0d
Source of Spectrum KC-1990-685-12
Wiley ID 1368496