CID 206514

1-methyl-2-phenylperimidine

Structural Information

Molecular Formula
C18H14N2
SMILES
CN1C2=CC=CC3=C2C(=CC=C3)N=C1C4=CC=CC=C4
InChI
InChI=1S/C18H14N2/c1-20-16-12-6-10-13-9-5-11-15(17(13)16)19-18(20)14-7-3-2-4-8-14/h2-12H,1H3
InChIKey
XUWNGBLFFSLDFH-UHFFFAOYSA-N
Compound name
1-methyl-2-phenylperimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

258.1157 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.12298 160.5
[M+Na]+ 281.10492 169.8
[M-H]- 257.10842 165.5
[M+NH4]+ 276.14952 176.7
[M+K]+ 297.07886 163.2
[M+H-H2O]+ 241.11296 150.3
[M+HCOO]- 303.11390 178.8
[M+CH3COO]- 317.12955 172.0
[M+Na-2H]- 279.09037 169.6
[M]+ 258.11515 160.6
[M]- 258.11625 160.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe