| SpectraBase Spectrum ID |
391hSnEXHv8 |
| Name |
3-Benzyl-8-(3-nitrophenyl)adenine |
| Alternate Name(s) |
3-benzyl-8-(3-nitrophenyl)-3H-purin-6-amine
3-benzyl-8-(3-nitrophenyl)-3H-purin-6-ylamine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14N6O2 |
| InChI |
InChI=1S/C18H14N6O2/c19-16-15-18(23(11-20-16)10-12-5-2-1-3-6-12)22-17(21-15)13-7-4-8-14(9-13)24(25)26/h1-9,11H,10,19H2 |
| InChIKey |
QGSHTAYOIBHEGM-UHFFFAOYSA-N |
| Molecular Weight |
346.350 g/mol |
| SMILES |
NC=1N=CN(C=2C1N=C(c1cc(N(=O)=O)ccc1)N2)Cc1ccccc1 |
| SPLASH |
splash10-0006-9003000000-e634fdc27b0fa9c4da7b |
| Source of Spectrum |
SO-0-1708-5 |
| Wiley ID |
878575 |
