SpectraBase Spectrum ID |
IHgfB98uHfa |
Name |
exo-[1-[N-[2-(4,7-methano-1H-isoindol-1,3(2H)-dion-1-yl)ethyl]acetamido]adenine monomer |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H19N7O3 |
InChI |
InChI=1S/C18H19N7O3/c19-15-14-16(22-7-21-15)24(8-23-14)6-11(26)20-3-4-25-17(27)12-9-1-2-10(5-9)13(12)18(25)28/h1-2,7-10,12-13H,3-6H2,(H,20,26)(H2,19,21,22)/t9-,10+,12?,13? |
InChIKey |
AUQSPJOWZXBQSB-ASZHBFLOSA-N |
Molecular Weight |
381.396 g/mol |
SMILES |
N(C(C[n]1c2c(c(ncn2)N)nc1)=O)CCN1C(C2[C@]3(C=C[C@@](C2C1=O)(C3)[H])[H])=O |
SPLASH |
splash10-001i-0009000000-40ce45442e65ee73e570 |
Source of Spectrum |
K-2001-3374-17 |
Wiley ID |
1580208 |