CID 213752

5-methoxyquinazoline-2,4-diamine

Structural Information

Molecular Formula
C9H10N4O
SMILES
COC1=CC=CC2=C1C(=NC(=N2)N)N
InChI
InChI=1S/C9H10N4O/c1-14-6-4-2-3-5-7(6)8(10)13-9(11)12-5/h2-4H,1H3,(H4,10,11,12,13)
InChIKey
FYEWYRWGCVGNJW-UHFFFAOYSA-N
Compound name
5-methoxyquinazoline-2,4-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

32
Patents

190.08546 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.09274 139.4
[M+Na]+ 213.07468 149.5
[M-H]- 189.07818 141.3
[M+NH4]+ 208.11928 156.9
[M+K]+ 229.04862 146.1
[M+H-H2O]+ 173.08272 131.8
[M+HCOO]- 235.08366 162.3
[M+CH3COO]- 249.09931 188.3
[M+Na-2H]- 211.06013 147.6
[M]+ 190.08491 138.4
[M]- 190.08601 138.4
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