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1,3-Dithiane-2-carboxylic acid, 2-[6-[2-(2,5-dioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl]-, methyl ester
SpectraBase Compound ID 1BTaycrJ9GB
InChI InChI=1S/C19H21NO6S2/c1-24-18(23)19(27-7-2-8-28-19)13-10-15-14(25-11-26-15)9-12(13)5-6-20-16(21)3-4-17(20)22/h9-10H,2-8,11H2,1H3
InChIKey FDNZVHVEAMSGCX-UHFFFAOYSA-N
Mol Weight 423.5 g/mol
Molecular Formula C19H21NO6S2
Exact Mass 423.08103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dt4dOz1WNL
Name 1,3-Dithiane-2-carboxylic acid, 2-[6-[2-(2,5-dioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl]-, methyl ester
CAS Registry Number 124021-83-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO6S2
InChI InChI=1S/C19H21NO6S2/c1-24-18(23)19(27-7-2-8-28-19)13-10-15-14(25-11-26-15)9-12(13)5-6-20-16(21)3-4-17(20)22/h9-10H,2-8,11H2,1H3
InChIKey FDNZVHVEAMSGCX-UHFFFAOYSA-N
Molecular Weight 423.498 g/mol
SMILES C1(c2c(cc3c(c2)OCO3)CCN2C(CCC2=O)=O)(C(=O)OC)SCCCS1
SPLASH splash10-07vj-0096100000-633ca1fc155a6c0fcaf0
Source of Spectrum J-55-835-23
Synonyms Methyl 2-{6-[2-(2,5-dioxo-1-pyrrolidinyl)ethyl]-1,3-benzodioxol-5-yl}-1,3-dithiane-2-carboxylate
Wiley ID 1378895