| SpectraBase Spectrum ID |
HiZEjfgO5Zu |
| Name |
1H-Purine, 1-methyl-6-(methylthio)-, picrate |
| Alternate Name(s) |
1-Methyl-6-methylthiopurine picrate
2,4,6-trinitrophenol compound with methyl 1-methyl-1H-purin-6-yl sulfide (1:1) |
| CAS Registry Number |
1246-49-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H11N7O7S |
| InChI |
InChI=1S/C7H8N4S.C6H3N3O7/c1-11-4-10-6-5(7(11)12-2)8-3-9-6;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h3-4H,1-2H3;1-2,10H |
| InChIKey |
AFHXZGYJRKMWPE-UHFFFAOYSA-N |
| Molecular Weight |
409.333 g/mol |
| SMILES |
Oc1c(N(=O)=O)cc(N(=O)=O)cc1N(=O)=O.C12=C(N(C)C=NC2=NC=N1)SC |
| SPLASH |
splash10-0543-7900000000-14fc94806e2fad3c6700 |
| Source of Spectrum |
O5-0-279-0 |
| Wiley ID |
1373241 |
