CID 1715074

N-(3-(phenylamino)allylidene)aniline monohydrochloride

Structural Information

Molecular Formula
C15H14N2
SMILES
C1=CC=C(C=C1)N/C=C/C=NC2=CC=CC=C2
InChI
InChI=1S/C15H14N2/c1-3-8-14(9-4-1)16-12-7-13-17-15-10-5-2-6-11-15/h1-13,16H/b12-7+,17-13?
InChIKey
ZFYNTCNECVPHDZ-RMPAWCBFSA-N
Compound name
N-[(E)-3-phenyliminoprop-1-enyl]aniline
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

475
Patents

222.11569 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.122966 149.3
[M+Na]+ 245.104908 155.0
[M-H]- 221.108414 156.8
[M+NH4]+ 240.149513 167.2
[M+K]+ 261.078848 150.4
[M+H-H2O]+ 205.112950 141.1
[M+HCOO]- 267.113891 177.4
[M+CH3COO]- 281.129541 194.5
[M+Na-2H]- 243.090356 158.2
[M]+ 222.11514142 147.7
[M]- 222.11623858 147.7
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