![[1,2,4]Triazolo[4,3-a]pyrimidine-5(6H)-thione, 7-methyl-](/api/spectrum/4Mh7fR9XCC/structure.png?h=300&w=458 "[1,2,4]Triazolo[4,3-a]pyrimidine-5(6H)-thione, 7-methyl-")
| SpectraBase Compound ID | GJlH3iZ3EP2 |
|---|---|
| InChI | InChI=1S/C6H6N4S/c1-4-2-5(11)10-3-7-9-6(10)8-4/h3H,2H2,1H3 |
| InChIKey | YXUBHBQTLLQLLQ-UHFFFAOYSA-N |
| Mol Weight | 166.2 g/mol |
| Molecular Formula | C6H6N4S |
| Exact Mass | 166.031317 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4Mh7fR9XCC |
|---|---|
| Name | [1,2,4]Triazolo[4,3-a]pyrimidine-5(6H)-thione, 7-methyl- |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6N4S |
| InChI | InChI=1S/C6H6N4S/c1-4-2-5(11)10-3-7-9-6(10)8-4/h3H,2H2,1H3 |
| InChIKey | YXUBHBQTLLQLLQ-UHFFFAOYSA-N |
| Molecular Weight | 166.202 g/mol |
| SMILES | CC1=Nc2[n](cnn2)C(C1)=S |
| SPLASH | splash10-0670-9600000000-c71caaa3b1cb32ece901 |
| Source of Spectrum | IY-1-4399-4 |
| Wiley ID | 1651977 |