CID 135417397

2-benzylamino-1-methyl perimidine

Structural Information

Molecular Formula
C19H17N3
SMILES
CN1C2=CC=CC3=C2C(=CC=C3)NC1=NCC4=CC=CC=C4
InChI
InChI=1S/C19H17N3/c1-22-17-12-6-10-15-9-5-11-16(18(15)17)21-19(22)20-13-14-7-3-2-4-8-14/h2-12H,13H2,1H3,(H,20,21)
InChIKey
SVEXDQMRDVZPHR-UHFFFAOYSA-N
Compound name
N-benzyl-3-methyl-1H-perimidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.14224 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.14952 168.4
[M+Na]+ 310.13146 185.0
[M+NH4]+ 305.17606 178.2
[M+K]+ 326.10540 174.5
[M-H]- 286.13496 174.3
[M+Na-2H]- 308.11691 177.2
[M]+ 287.14169 172.6
[M]- 287.14279 172.6
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.