CID 5273473

(2e)-n-(2-nitrophenyl)-3-phenylprop-2-enamide

Structural Information

Molecular Formula
C15H12N2O3
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NC2=CC=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C15H12N2O3/c18-15(11-10-12-6-2-1-3-7-12)16-13-8-4-5-9-14(13)17(19)20/h1-11H,(H,16,18)/b11-10+
InChIKey
YDJUEIUOYJLVFY-ZHACJKMWSA-N
Compound name
(E)-N-(2-nitrophenyl)-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

268.08478 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.092056 159.5
[M+Na]+ 291.073998 164.4
[M-H]- 267.077504 165.9
[M+NH4]+ 286.118603 174.1
[M+K]+ 307.047938 156.4
[M+H-H2O]+ 251.082040 155.9
[M+HCOO]- 313.082981 185.2
[M+CH3COO]- 327.098631 192.0
[M+Na-2H]- 289.059446 166.4
[M]+ 268.08423142 156.6
[M]- 268.08532858 156.6
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

No patent data available for this compound.