CID 3075661

N,9-dicyclopropyl-9h-purin-6-amine

Structural Information

Molecular Formula
C11H13N5
SMILES
C1CC1NC2=C3C(=NC=N2)N(C=N3)C4CC4
InChI
InChI=1S/C11H13N5/c1-2-7(1)15-10-9-11(13-5-12-10)16(6-14-9)8-3-4-8/h5-8H,1-4H2,(H,12,13,15)
InChIKey
QYDSBWLAQUNGTM-UHFFFAOYSA-N
Compound name
N,9-dicyclopropylpurin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

215.1171 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.124376 173.5
[M+Na]+ 238.106318 183.9
[M-H]- 214.109824 178.9
[M+NH4]+ 233.150923 178.4
[M+K]+ 254.080258 177.7
[M+H-H2O]+ 198.114360 165.0
[M+HCOO]- 260.115301 192.8
[M+CH3COO]- 274.130951 182.0
[M+Na-2H]- 236.091766 176.7
[M]+ 215.11655142 176.9
[M]- 215.11764858 176.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.