SpectraBase Spectrum ID |
8bvd9LoX0u |
Name |
9-{2-[(Hydroxymethyl)cyclohex-1-en-1-yl]methyl}adenine |
Alternate Name(s) |
[2-[(6-aminopurin-9-yl)methyl]-1-cyclohexenyl]methanol
[2-[(6-aminopurin-9-yl)methyl]cyclohexen-1-yl]methanol |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H17N5O |
InChI |
InChI=1S/C13H17N5O/c14-12-11-13(16-7-15-12)18(8-17-11)5-9-3-1-2-4-10(9)6-19/h7-8,19H,1-6H2,(H2,14,15,16) |
InChIKey |
ANFNZNOHWOYZAC-UHFFFAOYSA-N |
Molecular Weight |
259.313 g/mol |
SMILES |
Nc1c2c([n](CC3=C(CO)CCCC3)cn2)ncn1 |
SPLASH |
splash10-000i-0900000000-7513f649549c9b9dc6bf |
Source of Spectrum |
J-65-5184-46 |
Wiley ID |
1533021 |