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.beta.-D-Glucopyranosiduronic acid, 1,2-dihydro(methylthio)naphthalenyl 2,4,3-tris-O-(trimethylsilyl)-, methyl ester
SpectraBase Compound ID IUhv3NMchPi
InChI InChI=1S/C27H46O7SSi3/c1-29-26(28)24-22(32-36(3,4)5)23(33-37(6,7)8)25(34-38(9,10)11)27(31-24)30-21-19-15-13-12-14-18(19)16-17-20(21)35-2/h12-17,20-25,27H,1-11H3/t20?,21?,22-,23-,24-,25+,27+/m0/s1
InChIKey UDEACSAGTWOAQV-QAOOFWAASA-N
Mol Weight 599.0 g/mol
Molecular Formula C27H46O7SSi3
Exact Mass 598.227205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzNBhlPHHHs
Name .beta.-D-Glucopyranosiduronic acid, 1,2-dihydro(methylthio)naphthalenyl 2,4,3-tris-O-(trimethylsilyl)-, methyl ester
CAS Registry Number 83250-86-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H46O7SSi3
InChI InChI=1S/C27H46O7SSi3/c1-29-26(28)24-22(32-36(3,4)5)23(33-37(6,7)8)25(34-38(9,10)11)27(31-24)30-21-19-15-13-12-14-18(19)16-17-20(21)35-2/h12-17,20-25,27H,1-11H3/t20?,21?,22-,23-,24-,25+,27+/m0/s1
InChIKey UDEACSAGTWOAQV-QAOOFWAASA-N
Molecular Weight 598.973 g/mol
SMILES [C@]1([C@@]([C@@](O[Si](C)(C)C)([C@@](O[C@@]1(C(=O)OC)[H])(OC1c2c(cccc2)C=CC1SC)[H])[H])(O[Si](C)(C)C)[H])(O[Si](C)(C)C)[H]
SPLASH splash10-00fr-0901000000-3157fd2e482691e94ddc
Source of Spectrum KO-9-250-9
Synonyms Methyl 2-(methylsulfanyl)-1,2-dihydro-1-naphthalenyl 2,3,4-tris-O-(trimethylsilyl)-.beta.-D-glucopyranosiduronate Per(trimethylsilyl)derivative of dihydromethylthio naphtholyl methyl monogluronide
Wiley ID 1409940