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1H-1,2,3,4-Tetrazole-1-acetamide, N-(6-cyano-1,3-benzodioxol-5-yl)-
SpectraBase Compound ID 2Q7MrSCTtPs
InChI InChI=1S/C11H8N6O3/c12-3-7-1-9-10(20-6-19-9)2-8(7)14-11(18)4-17-5-13-15-16-17/h1-2,5H,4,6H2,(H,14,18)
InChIKey NIYJIBCORZVMJX-UHFFFAOYSA-N
Mol Weight 272.22 g/mol
Molecular Formula C11H8N6O3
Exact Mass 272.065788 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID d4eDFVyVoC
Name 1H-1,2,3,4-Tetrazole-1-acetamide, N-(6-cyano-1,3-benzodioxol-5-yl)-
Alternate Name(s) N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-(1H-1,2,3,4-tetrazol-1-yl)acetamide N-(6-cyano-1,3-benzodioxol-5-yl)-2-(1-tetrazolyl)acetamide N-(6-cyano-1,3-benzodioxol-5-yl)-2-(1,2,3,4-tetrazol-1-yl)ethanamide
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Formula C11H8N6O3
InChI InChI=1S/C11H8N6O3/c12-3-7-1-9-10(20-6-19-9)2-8(7)14-11(18)4-17-5-13-15-16-17/h1-2,5H,4,6H2,(H,14,18)
InChIKey NIYJIBCORZVMJX-UHFFFAOYSA-N
Molecular Weight 272.224 g/mol
SMILES N(c1cc2c(cc1C#N)OCO2)C(C[n]1nnnc1)=O
SPLASH splash10-03di-7910000000-6c3dd66f45b07b236b05
Source of Spectrum IY-2-5113-6
Wiley ID 1659119