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2H-Pyran-4-acetic acid, 3,4-dihydro-2-methoxy-5-(methoxycarbonyl)-3-[2-(phenylsulfinyl)ethyl]-, methyl ester
SpectraBase Compound ID 1JzVm9xGfwm
InChI InChI=1S/C19H24O7S/c1-23-17(20)11-15-14(9-10-27(22)13-7-5-4-6-8-13)19(25-3)26-12-16(15)18(21)24-2/h4-8,12,14-15,19H,9-11H2,1-3H3
InChIKey PWCJSLUSXKJGQQ-UHFFFAOYSA-N
Mol Weight 396.45 g/mol
Molecular Formula C19H24O7S
Exact Mass 396.124274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xLWpQxYCWG
Name 2H-Pyran-4-acetic acid, 3,4-dihydro-2-methoxy-5-(methoxycarbonyl)-3-[2-(phenylsulfinyl)ethyl]-, methyl ester
CAS Registry Number 121866-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O7S
InChI InChI=1S/C19H24O7S/c1-23-17(20)11-15-14(9-10-27(22)13-7-5-4-6-8-13)19(25-3)26-12-16(15)18(21)24-2/h4-8,12,14-15,19H,9-11H2,1-3H3
InChIKey PWCJSLUSXKJGQQ-UHFFFAOYSA-N
Molecular Weight 396.454 g/mol
SMILES C=1(C(C(CCS(=O)c2ccccc2)C(OC1)OC)CC(=O)OC)C(=O)OC
SPLASH splash10-00kr-8941000000-8541f2d56bad2987d353
Source of Spectrum J-54-4087-29
Synonyms 3,4-Dihydro-2-methoxy-3-(phenylsulfinylethyl)-5-(methoxycarbonyl)-2H-pyran-4-acetic acid methyl ester Methyl 2-methoxy-4-(2-methoxy-2-oxoethyl)-3-[2-(phenylsulfinyl)ethyl]-3,4-dihydro-2H-pyran-5-carboxylate
Wiley ID 1367332