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(3aR,4R,6aS)-4-methoxy-3-(4-methoxyphenyl)-4,6a-dihydro-3aH-furo[3,4-d]triazol-6-one
SpectraBase Compound ID 74MFomSAIyq
InChI InChI=1S/C12H13N3O4/c1-17-8-5-3-7(4-6-8)15-10-9(13-14-15)11(16)19-12(10)18-2/h3-6,9-10,12H,1-2H3/t9-,10+,12+/m0/s1
InChIKey ZAXRJDKIBLFEPY-HOSYDEDBSA-N
Mol Weight 263.25 g/mol
Molecular Formula C12H13N3O4
Exact Mass 263.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9y2Px0WxC1X
Name (3aR,4R,6aS)-4-methoxy-3-(4-methoxyphenyl)-4,6a-dihydro-3aH-furo[3,4-d]triazol-6-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H13N3O4
InChI InChI=1S/C12H13N3O4/c1-17-8-5-3-7(4-6-8)15-10-9(13-14-15)11(16)19-12(10)18-2/h3-6,9-10,12H,1-2H3/t9-,10+,12+/m0/s1
InChIKey ZAXRJDKIBLFEPY-HOSYDEDBSA-N
Molecular Weight 263.253 g/mol
SMILES [C@]12(N(N=N[C@@]1(C(O[C@]2(OC)[H])=O)[H])c1ccc(cc1)OC)[H]
SPLASH splash10-004i-0900000000-e14b0a0d1a717b9ef124
Source of Spectrum H1-52-245-5
Synonyms (3aR,4R,6aS)-4-methoxy-3-(4-methoxyphenyl)-4,6a-dihydro-3aH-furo[3,4-d][1,2,3]triazol-6-one
Wiley ID 817605