CID 6279093

2-(2-(2-methoxyphenyl)vinyl)quinoline

Structural Information

Molecular Formula
C18H15NO
SMILES
COC1=CC=CC=C1/C=C/C2=NC3=CC=CC=C3C=C2
InChI
InChI=1S/C18H15NO/c1-20-18-9-5-3-7-15(18)11-13-16-12-10-14-6-2-4-8-17(14)19-16/h2-13H,1H3/b13-11+
InChIKey
CRKXXGYVXSKYIV-ACCUITESSA-N
Compound name
2-[(E)-2-(2-methoxyphenyl)ethenyl]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

261.11536 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.12264 160.5
[M+Na]+ 284.10458 169.0
[M-H]- 260.10808 166.5
[M+NH4]+ 279.14918 176.7
[M+K]+ 300.07852 163.1
[M+H-H2O]+ 244.11262 151.4
[M+HCOO]- 306.11356 182.3
[M+CH3COO]- 320.12921 172.5
[M+Na-2H]- 282.09003 168.0
[M]+ 261.11481 161.4
[M]- 261.11591 161.4
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

patents stripe