| SpectraBase Compound ID | IKpv9u8TTom |
|---|---|
| InChI | InChI=1S/C8H13N3O/c1-8(2,3)7(12)4-11-6-9-5-10-11/h5-6H,4H2,1-3H3 |
| InChIKey | FMWWRALTYIWZEB-UHFFFAOYSA-N |
| Mol Weight | 167.21 g/mol |
| Molecular Formula | C8H13N3O |
| Exact Mass | 167.105862 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5Ltm3nepPSi |
|---|---|
| Name | 3,3-Dimethyl-1-(1H-1,2,4-triazolyl-1)-2-butanone |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H13N3O |
| InChI | InChI=1S/C8H13N3O/c1-8(2,3)7(12)4-11-6-9-5-10-11/h5-6H,4H2,1-3H3 |
| InChIKey | FMWWRALTYIWZEB-UHFFFAOYSA-N |
| Molecular Weight | 167.1056 |
| SMILES | C([n]1ncnc1)C(C(C)(C)C)=O |
| SPLASH | splash10-0a4i-9000000000-a05b3e0be4ed223df119 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |