CID 668463

2-(2,3-dimethoxyphenyl)-2,3-dihydro-1h-perimidine

Structural Information

Molecular Formula
C19H18N2O2
SMILES
COC1=CC=CC(=C1OC)C2NC3=CC=CC4=C3C(=CC=C4)N2
InChI
InChI=1S/C19H18N2O2/c1-22-16-11-5-8-13(18(16)23-2)19-20-14-9-3-6-12-7-4-10-15(21-19)17(12)14/h3-11,19-21H,1-2H3
InChIKey
ZXCPEWASUSUSGE-UHFFFAOYSA-N
Compound name
2-(2,3-dimethoxyphenyl)-2,3-dihydro-1H-perimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.13684 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.144116 173.2
[M+Na]+ 329.126058 180.7
[M-H]- 305.129564 175.3
[M+NH4]+ 324.170663 186.1
[M+K]+ 345.099998 173.9
[M+H-H2O]+ 289.134100 163.4
[M+HCOO]- 351.135041 187.0
[M+CH3COO]- 365.150691 182.4
[M+Na-2H]- 327.111506 179.4
[M]+ 306.13629142 172.0
[M]- 306.13738858 172.0
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.