CID 6184681

4-(2-(3,4-dimethoxyphenyl)vinyl)quinoline

Structural Information

Molecular Formula
C19H17NO2
SMILES
COC1=C(C=C(C=C1)/C=C/C2=CC=NC3=CC=CC=C23)OC
InChI
InChI=1S/C19H17NO2/c1-21-18-10-8-14(13-19(18)22-2)7-9-15-11-12-20-17-6-4-3-5-16(15)17/h3-13H,1-2H3/b9-7+
InChIKey
NFGZBGNIUGXLOT-VQHVLOKHSA-N
Compound name
4-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.12592 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.133196 168.7
[M+Na]+ 314.115138 177.5
[M-H]- 290.118644 175.0
[M+NH4]+ 309.159743 183.9
[M+K]+ 330.089078 172.0
[M+H-H2O]+ 274.123180 159.3
[M+HCOO]- 336.124121 190.3
[M+CH3COO]- 350.139771 180.4
[M+Na-2H]- 312.100586 174.9
[M]+ 291.12537142 171.7
[M]- 291.12646858 171.7
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.