CID 10419563

90860-35-8

Structural Information

Molecular Formula
C7H12N4O
SMILES
CN(C)C1=C(C(=NC=N1)OC)N
InChI
InChI=1S/C7H12N4O/c1-11(2)6-5(8)7(12-3)10-4-9-6/h4H,8H2,1-3H3
InChIKey
NWBQVGDVWUAKGE-UHFFFAOYSA-N
Compound name
6-methoxy-4-N,4-N-dimethylpyrimidine-4,5-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

168.1011 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.10838 135.4
[M+Na]+ 191.09032 144.0
[M-H]- 167.09382 138.0
[M+NH4]+ 186.13492 153.5
[M+K]+ 207.06426 143.7
[M+H-H2O]+ 151.09836 127.6
[M+HCOO]- 213.09930 160.2
[M+CH3COO]- 227.11495 187.6
[M+Na-2H]- 189.07577 142.2
[M]+ 168.10055 136.5
[M]- 168.10165 136.5
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

patents stripe