CID 75276

N-benzylidene-p-toluidine

Structural Information

Molecular Formula
C14H13N
SMILES
CC1=CC=C(C=C1)N=CC2=CC=CC=C2
InChI
InChI=1S/C14H13N/c1-12-7-9-14(10-8-12)15-11-13-5-3-2-4-6-13/h2-11H,1H3
InChIKey
MSFVFFZPHJPOHP-UHFFFAOYSA-N
Compound name
N-(4-methylphenyl)-1-phenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

246
Patents

195.1048 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.11208 141.9
[M+Na]+ 218.09402 149.5
[M-H]- 194.09752 150.0
[M+NH4]+ 213.13862 161.6
[M+K]+ 234.06796 145.8
[M+H-H2O]+ 178.10206 134.4
[M+HCOO]- 240.10300 169.1
[M+CH3COO]- 254.11865 189.2
[M+Na-2H]- 216.07947 150.2
[M]+ 195.10425 141.8
[M]- 195.10535 141.8
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