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ACETIC ACID, 4-ACETOXY-2-(2-ACETYLSULFANYL-ETHYL)-5-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-3-YLMETHYL ESTER

View entire compound with spectra: 1 MS (GC)

ACETIC ACID, 4-ACETOXY-2-(2-ACETYLSULFANYL-ETHYL)-5-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-3-YLMETHYL ESTER
SpectraBase Compound ID 7WgGzmPcMf7
InChI InChI=1S/C17H26N2O8S/c1-9(20)25-8-12-13(5-7-28-11(3)22)27-16(15(12)26-10(2)21)19-6-4-14(23)18-17(19)24/h4,6,12-18,23-24H,5,7-8H2,1-3H3
InChIKey DCCGEOHEJJDSMC-UHFFFAOYSA-N
Mol Weight 418.46 g/mol
Molecular Formula C17H26N2O8S
Exact Mass 418.140987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Tn7XiAFiPr
Name ACETIC ACID, 4-ACETOXY-2-(2-ACETYLSULFANYL-ETHYL)-5-(2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-3-YLMETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H22N2O8S
InChI InChI=1S/C17H26N2O8S/c1-9(20)25-8-12-13(5-7-28-11(3)22)27-16(15(12)26-10(2)21)19-6-4-14(23)18-17(19)24/h4,6,12-18,23-24H,5,7-8H2,1-3H3
InChIKey DCCGEOHEJJDSMC-UHFFFAOYSA-N
Molecular Weight 418.1403
SMILES OC1N(C=CC(O)N1)C1OC(CCSC(=O)C)C(COC(=O)C)C1OC(=O)C
SPLASH splash10-0006-9510000000-8a89d44791a1d82dd13f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany