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]+ 190.108716 143.2
[M+Na]+ 212.090658 154.4
[M-H]- 188.094164 143.2
[M+NH4]+ 207.135263 158.9
[M+K]+ 228.064598 150.4
[M+H-H2O]+ 172.098700 134.4
[M+HCOO]- 234.099641 163.3
[M+CH3COO]- 248.115291 155.7
[M+Na-2H]- 210.076106 152.9
[M]+ 189.10089142 144.4
[M]- 189.10198858 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.