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5-(1H-Tetraazol-5-yl)-2-benzofuran-1(3H)-one
SpectraBase Compound ID 8tQ4CS0leXn
InChI InChI=1S/C9H6N4O2/c14-9-7-2-1-5(3-6(7)4-15-9)8-10-12-13-11-8/h1-3H,4H2,(H,10,11,12,13)
InChIKey AOLUSWAOLYDMPA-UHFFFAOYSA-N
Mol Weight 202.17 g/mol
Molecular Formula C9H6N4O2
Exact Mass 202.049075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OXSiAhqlmc
Name 5-(1H-Tetraazol-5-yl)-2-benzofuran-1(3H)-one
Alternate Name(s) 5-(2H-1,2,3,4-tetrazol-5-yl)-3H-2-benzofuran-1-one 5-(2H-tetrazol-5-yl)-3H-2-benzofuran-1-one 5-(2H-tetrazol-5-yl)-3H-isobenzofuran-1-one 5-(2H-tetrazol-5-yl)phthalide Isobenzofuran-1(3H)-one, 5-(5-tetrazolyl)-
CAS Registry Number 330842-02-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N4O2
InChI InChI=1S/C9H6N4O2/c14-9-7-2-1-5(3-6(7)4-15-9)8-10-12-13-11-8/h1-3H,4H2,(H,10,11,12,13)
InChIKey AOLUSWAOLYDMPA-UHFFFAOYSA-N
Molecular Weight 202.173 g/mol
SMILES [nH]1c(nnn1)-c1cc2c(cc1)C(OC2)=O
SPLASH splash10-00di-8900000000-ecfdbd536471f9dd99bd
Source of Spectrum AD-0-2532-0
Wiley ID 1431106