CID 1787877

(2z)-n-(3,4-dimethylphenyl)-3-(naphthalen-1-yl)prop-2-enamide

Structural Information

Molecular Formula
C21H19NO
SMILES
CC1=C(C=C(C=C1)NC(=O)/C=C\C2=CC=CC3=CC=CC=C32)C
InChI
InChI=1S/C21H19NO/c1-15-10-12-19(14-16(15)2)22-21(23)13-11-18-8-5-7-17-6-3-4-9-20(17)18/h3-14H,1-2H3,(H,22,23)/b13-11-
InChIKey
AGISHRROGWYVBN-QBFSEMIESA-N
Compound name
(Z)-N-(3,4-dimethylphenyl)-3-naphthalen-1-ylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.14667 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.15395 173.4
[M+Na]+ 324.13589 189.1
[M+NH4]+ 319.18049 182.5
[M+K]+ 340.10983 179.1
[M-H]- 300.13939 179.7
[M+Na-2H]- 322.12134 182.7
[M]+ 301.14612 177.6
[M]- 301.14722 177.6
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.