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]+ 216.12438 173.5
[M+Na]+ 238.10632 183.9
[M-H]- 214.10982 178.9
[M+NH4]+ 233.15092 178.4
[M+K]+ 254.08026 177.7
[M+H-H2O]+ 198.11436 165.0
[M+HCOO]- 260.11530 192.8
[M+CH3COO]- 274.13095 182.0
[M+Na-2H]- 236.09177 176.7
[M]+ 215.11655 176.9
[M]- 215.11765 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.