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5H-Thiazolo[3,2-c]pyrimidine-3-carboxylic acid, 8-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)hexahydro-2,2-dimethyl-5,7- dioxo-, methyl ester, [3S-(3.alpha.,8.beta.,8a.alpha.)]-
SpectraBase Compound ID wWzbIdmTKm
InChI InChI=1S/C18H17N3O6S/c1-18(2)11(16(25)27-3)21-15(28-18)10(12(22)19-17(21)26)20-13(23)8-6-4-5-7-9(8)14(20)24/h4-7,10-11,15H,1-3H3,(H,19,22,26)/t10-,11-,15-/m1/s1
InChIKey ONEHGZODINHLSJ-UEKVPHQBSA-N
Mol Weight 403.41 g/mol
Molecular Formula C18H17N3O6S
Exact Mass 403.083806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJyLQZDgy1I
Name 5H-Thiazolo[3,2-c]pyrimidine-3-carboxylic acid, 8-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)hexahydro-2,2-dimethyl-5,7- dioxo-, methyl ester, [3S-(3.alpha.,8.beta.,8a.alpha.)]-
Alternate Name(s) (3R,8R,8aR)-methyl 2,2-dimethyl-5,7-dioxo-8-phthalimidoperhydrothiazolo-(3,2-c)pyrimidine-3-carboxylate Methyl (3R,8R,8aR)-8-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-2,2-dimethyl-5,7-dioxohexahydro-5H-[1,3]thiazolo[3,2-c]pyrimidine-3-carboxylate
CAS Registry Number 69221-26-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N3O6S
InChI InChI=1S/C18H17N3O6S/c1-18(2)11(16(25)27-3)21-15(28-18)10(12(22)19-17(21)26)20-13(23)8-6-4-5-7-9(8)14(20)24/h4-7,10-11,15H,1-3H3,(H,19,22,26)/t10-,11-,15-/m1/s1
InChIKey ONEHGZODINHLSJ-UEKVPHQBSA-N
Molecular Weight 403.409 g/mol
SMILES N1C([C@]([C@@]2(N(C1=O)[C@@](C(S2)(C)C)(C(=O)OC)[H])[H])(N1C(c2ccccc2C1=O)=O)[H])=O
SPLASH splash10-0avi-0891000000-6f8321c4d051f3efdeee
Source of Spectrum KC-1978-820-0
Wiley ID 1370800