CID 3047482

Brn 0630712

Structural Information

Molecular Formula
C24H27N3O2
SMILES
CN(C)CCCN1C2=CC=CC3=C2C(=CC=C3)N=C1C4=CC(=C(C=C4)OC)OC
InChI
InChI=1S/C24H27N3O2/c1-26(2)14-7-15-27-20-11-6-9-17-8-5-10-19(23(17)20)25-24(27)18-12-13-21(28-3)22(16-18)29-4/h5-6,8-13,16H,7,14-15H2,1-4H3
InChIKey
FRFXKUZDPKGIHE-UHFFFAOYSA-N
Compound name
3-[2-(3,4-dimethoxyphenyl)perimidin-1-yl]-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.21033 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.21761 199.5
[M+Na]+ 412.19955 206.4
[M-H]- 388.20305 205.3
[M+NH4]+ 407.24415 210.7
[M+K]+ 428.17349 201.5
[M+H-H2O]+ 372.20759 187.4
[M+HCOO]- 434.20853 217.1
[M+CH3COO]- 448.22418 208.4
[M+Na-2H]- 410.18500 203.7
[M]+ 389.20978 205.6
[M]- 389.21088 205.6
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.