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3-(2H-1,2,3,4-tetrazol-5-ylamino)cyclohex-2-en-1-one
SpectraBase Compound ID 92f4y4jSa3T
InChI InChI=1S/C7H9N5O/c13-6-3-1-2-5(4-6)8-7-9-11-12-10-7/h4H,1-3H2,(H2,8,9,10,11,12)
InChIKey REZXFQGPXQJVJG-UHFFFAOYSA-N
Mol Weight 179.18 g/mol
Molecular Formula C7H9N5O
Exact Mass 179.08071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 53r8xdf3dw
Name 3-(2H-1,2,3,4-tetrazol-5-ylamino)cyclohex-2-en-1-one
Alternate Name(s) 3-(2H-tetrazol-5-ylamino)-1-cyclohex-2-enone 3-(2H-tetrazol-5-ylamino)cyclohex-2-en-1-one Cyclohex-2-enone, 3-(2H-tetrazol-5-ylamino)-
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Formula C7H9N5O
InChI InChI=1S/C7H9N5O/c13-6-3-1-2-5(4-6)8-7-9-11-12-10-7/h4H,1-3H2,(H2,8,9,10,11,12)
InChIKey REZXFQGPXQJVJG-UHFFFAOYSA-N
Molecular Weight 179.183 g/mol
SMILES N(c1n[nH]nn1)C=1CCCC(C1)=O
SPLASH splash10-00ko-9000000000-8e452b1c1eb04e921e4e
Wiley ID 1445880