CID 177843218

Dtxsid601369362

Structural Information

Molecular Formula
C25H24N4
SMILES
CC1(NC2=CC=CC3=C2C(=CC=C3)N1)CC4(NC5=CC=CC6=C5C(=CC=C6)N4)C
InChI
InChI=1S/C25H24N4/c1-24(26-18-11-3-7-16-8-4-12-19(27-24)22(16)18)15-25(2)28-20-13-5-9-17-10-6-14-21(29-25)23(17)20/h3-14,26-29H,15H2,1-2H3
InChIKey
MCNRENCHTJPXFX-UHFFFAOYSA-N
Compound name
2-methyl-2-[(2-methyl-1,3-dihydroperimidin-2-yl)methyl]-1,3-dihydroperimidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

380.2001 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.20738 196.3
[M+Na]+ 403.18932 204.2
[M-H]- 379.19282 194.0
[M+NH4]+ 398.23392 207.5
[M+K]+ 419.16326 192.4
[M+H-H2O]+ 363.19736 182.0
[M+HCOO]- 425.19830 199.7
[M+CH3COO]- 439.21395 201.3
[M+Na-2H]- 401.17477 204.7
[M]+ 380.19955 190.4
[M]- 380.20065 190.4
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.