CID 690158

Cinnamanilide

Structural Information

Molecular Formula
C15H13NO
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2
InChI
InChI=1S/C15H13NO/c17-15(16-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H,(H,16,17)/b12-11+
InChIKey
FIIZQHKGJMRJIL-VAWYXSNFSA-N
Compound name
(E)-N,3-diphenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

123
Patents

223.09972 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.10700 150.2
[M+Na]+ 246.08894 156.0
[M-H]- 222.09244 156.5
[M+NH4]+ 241.13354 167.6
[M+K]+ 262.06288 151.5
[M+H-H2O]+ 206.09698 142.5
[M+HCOO]- 268.09792 175.0
[M+CH3COO]- 282.11357 189.8
[M+Na-2H]- 244.07439 156.9
[M]+ 223.09917 148.1
[M]- 223.10027 148.1
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