CID 5354071

(2e)-1-(4-aminophenyl)-3-phenylprop-2-en-1-one

Structural Information

Molecular Formula
C15H13NO
SMILES
C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C15H13NO/c16-14-9-7-13(8-10-14)15(17)11-6-12-4-2-1-3-5-12/h1-11H,16H2/b11-6+
InChIKey
VEKSFLTVXIEEAX-IZZDOVSWSA-N
Compound name
(E)-1-(4-aminophenyl)-3-phenylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

9
Patents

223.09972 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.10700 150.4
[M+Na]+ 246.08894 157.1
[M-H]- 222.09244 156.6
[M+NH4]+ 241.13354 167.8
[M+K]+ 262.06288 152.3
[M+H-H2O]+ 206.09698 143.0
[M+HCOO]- 268.09792 174.5
[M+CH3COO]- 282.11357 190.9
[M+Na-2H]- 244.07439 155.4
[M]+ 223.09917 147.9
[M]- 223.10027 147.9
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

No patent data available for this compound.