CID 5378298

22359-67-7

Structural Information

Molecular Formula
C20H16O2
SMILES
COC1=CC=C(C=C1)/C=C/C(=O)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C20H16O2/c1-22-19-11-6-15(7-12-19)8-13-20(21)18-10-9-16-4-2-3-5-17(16)14-18/h2-14H,1H3/b13-8+
InChIKey
VZFRSPMIFYIXSS-MDWZMJQESA-N
Compound name
(E)-3-(4-methoxyphenyl)-1-naphthalen-2-ylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

288.11502 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.12230 167.3
[M+Na]+ 311.10424 174.8
[M-H]- 287.10774 174.7
[M+NH4]+ 306.14884 183.6
[M+K]+ 327.07818 169.2
[M+H-H2O]+ 271.11228 158.9
[M+HCOO]- 333.11322 189.2
[M+CH3COO]- 347.12887 202.6
[M+Na-2H]- 309.08969 172.6
[M]+ 288.11447 168.5
[M]- 288.11557 168.5
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.