CID 1284736

4-(phenylamino)-2-(phenylimino)-3-pentene

Structural Information

Molecular Formula
C17H18N2
SMILES
CC(=CC(=NC1=CC=CC=C1)C)NC2=CC=CC=C2
InChI
InChI=1S/C17H18N2/c1-14(18-16-9-5-3-6-10-16)13-15(2)19-17-11-7-4-8-12-17/h3-13,18H,1-2H3
InChIKey
PWYOZUDBDQUBBL-UHFFFAOYSA-N
Compound name
N-(4-phenyliminopent-2-en-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

250.147 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.15428 160.1
[M+Na]+ 273.13622 164.3
[M-H]- 249.13972 167.3
[M+NH4]+ 268.18082 176.6
[M+K]+ 289.11016 160.2
[M+H-H2O]+ 233.14426 151.6
[M+HCOO]- 295.14520 185.4
[M+CH3COO]- 309.16085 202.1
[M+Na-2H]- 271.12167 165.3
[M]+ 250.14645 157.8
[M]- 250.14755 157.8
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

patents stripe