CID 208769

Brn 1466509

Structural Information

Molecular Formula
C15H19ClN2
SMILES
CC1=C(C=C(C=C1)N=C2CCCCN2CC=C)Cl
InChI
InChI=1S/C15H19ClN2/c1-3-9-18-10-5-4-6-15(18)17-13-8-7-12(2)14(16)11-13/h3,7-8,11H,1,4-6,9-10H2,2H3
InChIKey
FEIHNCSUAIVNOL-UHFFFAOYSA-N
Compound name
N-(3-chloro-4-methylphenyl)-1-prop-2-enylpiperidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.1237 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.13098 162.2
[M+Na]+ 285.11292 169.1
[M-H]- 261.11642 167.8
[M+NH4]+ 280.15752 178.9
[M+K]+ 301.08686 163.2
[M+H-H2O]+ 245.12096 154.2
[M+HCOO]- 307.12190 178.8
[M+CH3COO]- 321.13755 200.9
[M+Na-2H]- 283.09837 164.7
[M]+ 262.12315 160.7
[M]- 262.12425 160.7
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.