CID 6142434

N-(cinnamylidene)-m-toluidine

Structural Information

Molecular Formula
C16H15N
SMILES
CC1=CC(=CC=C1)N=C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C16H15N/c1-14-7-5-11-16(13-14)17-12-6-10-15-8-3-2-4-9-15/h2-13H,1H3/b10-6+,17-12?
InChIKey
SKDRYCBGCDIECH-PYJFJABNSA-N
Compound name
(E)-N-(3-methylphenyl)-3-phenylprop-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.12045 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.127726 150.2
[M+Na]+ 244.109668 157.4
[M-H]- 220.113174 158.1
[M+NH4]+ 239.154273 168.9
[M+K]+ 260.083608 152.6
[M+H-H2O]+ 204.117710 142.4
[M+HCOO]- 266.118651 177.0
[M+CH3COO]- 280.134301 193.7
[M+Na-2H]- 242.095116 157.4
[M]+ 221.11990142 150.0
[M]- 221.12099858 150.0
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

No patent data available for this compound.