-triazol-4-one - oxime](/api/spectrum/Ka4etc32Wwk/structure.png?h=300&w=458 "(E)-4,5,6,7-Tetrahydro-6,6-dimethyl-2-(4'-chlorophenyl)-2H-benzo[d](1,2,3)-triazol-4-one - oxime")
| SpectraBase Compound ID | HcZGFNDB3Nn |
|---|---|
| InChI | InChI=1S/C14H15ClN4O/c1-14(2)7-11-13(12(8-14)18-20)17-19(16-11)10-5-3-9(15)4-6-10/h3-6,20H,7-8H2,1-2H3/b18-12+ |
| InChIKey | XMSZGLPTFJPDTE-LDADJPATSA-N |
| Mol Weight | 290.75 g/mol |
| Molecular Formula | C14H15ClN4O |
| Exact Mass | 290.093439 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Ka4etc32Wwk |
|---|---|
| Name | (E)-4,5,6,7-Tetrahydro-6,6-dimethyl-2-(4'-chlorophenyl)-2H-benzo[d](1,2,3)-triazol-4-one - oxime |
| CAS Registry Number | 103869-92-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H15ClN4O |
| InChI | InChI=1S/C14H15ClN4O/c1-14(2)7-11-13(12(8-14)18-20)17-19(16-11)10-5-3-9(15)4-6-10/h3-6,20H,7-8H2,1-2H3/b18-12+ |
| InChIKey | XMSZGLPTFJPDTE-LDADJPATSA-N |
| Molecular Weight | 290.754 g/mol |
| SMILES | O\N=C\1c2n[n](-c3ccc(cc3)Cl)nc2CC(C1)(C)C |
| SPLASH | splash10-002f-0490000000-518ac8b73dab1cb2fc26 |
| Source of Spectrum | H-68-1752-3 |
| Synonyms | 4H-Benzotriazol-4-one, 2-(4-chlorophenyl)-2,5,6,7-tetrahydro-6,6-dimethyl-, oxime (4E)-2-(4-chlorophenyl)-6,6-dimethyl-2,5,6,7-tetrahydro-4H-1,2,3-benzotriazol-4-one oxime (E)-4,5,6,7-Tetrahydro-6,6-dimethyl-2-(4'-chlorophenyl)-2H-benzo[d](1,2,3)-triazol-4-one-oxime 2-(p-chlorophenyl)-4,5,6,7-tetrahydro-6,6-dimethyl-2H-benzo[d][1,2,3]triazol-4-one oxime |
| Wiley ID | 1293325 |