CID 3046495

Brn 0699960

Structural Information

Molecular Formula
C20H19N3O2
SMILES
CN1C2=CC=CC3=C2C(=CC=C3)N=C1NC4=CC(=C(C=C4)OC)OC
InChI
InChI=1S/C20H19N3O2/c1-23-16-9-5-7-13-6-4-8-15(19(13)16)22-20(23)21-14-10-11-17(24-2)18(12-14)25-3/h4-12H,1-3H3,(H,21,22)
InChIKey
UCFPVWOCVMKGNZ-UHFFFAOYSA-N
Compound name
N-(3,4-dimethoxyphenyl)-1-methylperimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.14774 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.15502 181.2
[M+Na]+ 356.13696 190.1
[M-H]- 332.14046 186.5
[M+NH4]+ 351.18156 194.4
[M+K]+ 372.11090 184.7
[M+H-H2O]+ 316.14500 170.3
[M+HCOO]- 378.14594 200.0
[M+CH3COO]- 392.16159 191.5
[M+Na-2H]- 354.12241 188.4
[M]+ 333.14719 184.9
[M]- 333.14829 184.9
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.