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4,6-Methanofuro[3,2-d]pyrimidine, acetamide deriv.
SpectraBase Compound ID DC1oaySmN9o
InChI InChI=1S/C13H17N3O6/c1-4(17)14-13-15-7-9-8(16-13)11(21-6(3)19)12(22-9)10(7)20-5(2)18/h7-12H,1-3H3,(H2,14,15,16,17)/t7-,8-,9-,10+,11+,12+/m0/s1
InChIKey UZJFPKZTFWOFIZ-PYZHKEBXSA-N
Mol Weight 311.29 g/mol
Molecular Formula C13H17N3O6
Exact Mass 311.111735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K91UWo70iM6
Name 4,6-Methanofuro[3,2-d]pyrimidine, acetamide deriv.
Alternate Name(s) Acetamide, N-[7,8-bis(acetyloxy)-1,4,4a,6,7,7a-hexahydro-4,6-methanofuro[3,2-d]pyrimidin-2-yl]-, (4.alpha.,4a.beta.,6.alpha.,7.be ta.,7a.beta.,8R*)-(.+-.)- (1.alpha.,5.alpha.,6.alpha.,7.beta.,9.beta.,10.alpha.)-3-(acetylimino)-8-oxa-2,4-diazatricyclo[5.2.1.0(5,9)]decane-6,10-diol diacetate (2R,3S,7R,10S)-5-(acetylimino)-10-(acetyloxy)-9-oxa-4,6-diazatricyclo[5.2.1.0(3,8)]dec-2-yl acetate
CAS Registry Number 97684-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N3O6
InChI InChI=1S/C13H17N3O6/c1-4(17)14-13-15-7-9-8(16-13)11(21-6(3)19)12(22-9)10(7)20-5(2)18/h7-12H,1-3H3,(H2,14,15,16,17)/t7-,8-,9-,10+,11+,12+/m0/s1
InChIKey UZJFPKZTFWOFIZ-PYZHKEBXSA-N
Molecular Weight 311.294 g/mol
SMILES N1[C@]2([C@]3([C@@]([C@]([C@@]([C@@]2(OC(=O)C)[H])(O3)[H])(OC(=O)C)[H])(N\C1=N\C(=O)C)[H])[H])[H]
SPLASH splash10-0007-7291000000-76c60965f22675bee83d
Source of Spectrum K-118-2069-40
Wiley ID 1312248