CID 6479255

(e)-3-(quinolin-2-yl)prop-2-en-1-ol

Structural Information

Molecular Formula
C12H11NO
SMILES
C1=CC=C2C(=C1)C=CC(=N2)/C=C/CO
InChI
InChI=1S/C12H11NO/c14-9-3-5-11-8-7-10-4-1-2-6-12(10)13-11/h1-8,14H,9H2/b5-3+
InChIKey
HZSMCZGYICFQLI-HWKANZROSA-N
Compound name
(E)-3-quinolin-2-ylprop-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

14
Patents

185.08406 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.09134 138.8
[M+Na]+ 208.07328 147.3
[M-H]- 184.07678 140.6
[M+NH4]+ 203.11788 157.8
[M+K]+ 224.04722 142.7
[M+H-H2O]+ 168.08132 132.1
[M+HCOO]- 230.08226 159.9
[M+CH3COO]- 244.09791 179.4
[M+Na-2H]- 206.05873 147.6
[M]+ 185.08351 138.2
[M]- 185.08461 138.2
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.