CID 251773

4-pteridinamine, n,6,7-trimethyl-

Structural Information

Molecular Formula
C9H11N5
SMILES
CC1=C(N=C2C(=N1)C(=NC=N2)NC)C
InChI
InChI=1S/C9H11N5/c1-5-6(2)14-9-7(13-5)8(10-3)11-4-12-9/h4H,1-3H3,(H,10,11,12,14)
InChIKey
XZAFACWFMLGMKD-UHFFFAOYSA-N
Compound name
N,6,7-trimethylpteridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.10144 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.10872 143.2
[M+Na]+ 212.09066 154.4
[M-H]- 188.09416 143.2
[M+NH4]+ 207.13526 158.9
[M+K]+ 228.06460 150.4
[M+H-H2O]+ 172.09870 134.4
[M+HCOO]- 234.09964 163.3
[M+CH3COO]- 248.11529 155.7
[M+Na-2H]- 210.07611 152.9
[M]+ 189.10089 144.4
[M]- 189.10199 144.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.