CID 162468

41543-92-4

Structural Information

Molecular Formula
C16H16N2O
SMILES
CC(=C)C(=O)NC1=CC=C(C=C1)NC2=CC=CC=C2
InChI
InChI=1S/C16H16N2O/c1-12(2)16(19)18-15-10-8-14(9-11-15)17-13-6-4-3-5-7-13/h3-11,17H,1H2,2H3,(H,18,19)
InChIKey
GFSJJVJWCAMZEV-UHFFFAOYSA-N
Compound name
N-(4-anilinophenyl)-2-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2046
Patents

252.12627 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.13355 160.4
[M+Na]+ 275.11549 172.6
[M+NH4]+ 270.16009 168.3
[M+K]+ 291.08943 165.3
[M-H]- 251.11899 165.5
[M+Na-2H]- 273.10094 169.2
[M]+ 252.12572 163.4
[M]- 252.12682 163.4
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