SpectraBase Spectrum ID |
9mFoDFNZRM |
Name |
[1-(3,3-Dimethyl-2,4-dioxabicyclo[4.2.0]octyl)methyl]adenine |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H19N5O2 |
InChI |
InChI=1S/C14H19N5O2/c1-13(2)20-6-8-3-4-14(8,21-13)5-9-18-11(15)10-12(19-9)17-7-16-10/h7-8H,3-6H2,1-2H3,(H3,15,16,17,18,19) |
InChIKey |
ZDSPJAWGOPUCCO-UHFFFAOYSA-N |
Molecular Weight |
289.339 g/mol |
SMILES |
Nc1nc(nc2c1[nH]cn2)CC12OC(OCC2CC1)(C)C |
SPLASH |
splash10-0a4i-9010000000-386e75de72f5297ba0f8 |
Source of Spectrum |
J-65-5183-44 |
Synonyms |
2-[(3,3-dimethyl-2,4-dioxabicyclo[4.2.0]oct-1-yl)methyl]-7H-purin-6-amine
2-[(3,3-dimethyl-2,4-dioxabicyclo[4.2.0]oct-1-yl)methyl]-7H-purin-6-ylamine |
Wiley ID |
1533023 |