CID 6163637

23489-63-6

Structural Information

Molecular Formula
C21H19NO
SMILES
CN(C)C1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C21H19NO/c1-22(2)18-13-10-16(11-14-18)12-15-21(23)20-9-5-7-17-6-3-4-8-19(17)20/h3-15H,1-2H3/b15-12+
InChIKey
BBLNMQOXMADQJM-NTCAYCPXSA-N
Compound name
(E)-3-[4-(dimethylamino)phenyl]-1-naphthalen-1-ylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.14667 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.15395 172.4
[M+Na]+ 324.13589 178.6
[M-H]- 300.13939 180.8
[M+NH4]+ 319.18049 188.3
[M+K]+ 340.10983 173.6
[M+H-H2O]+ 284.14393 163.4
[M+HCOO]- 346.14487 195.1
[M+CH3COO]- 360.16052 211.8
[M+Na-2H]- 322.12134 176.7
[M]+ 301.14612 173.0
[M]- 301.14722 173.0
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.