CID 279621

5-(ethoxymethyl)quinolin-8-ol

Structural Information

Molecular Formula
C12H13NO2
SMILES
CCOCC1=C2C=CC=NC2=C(C=C1)O
InChI
InChI=1S/C12H13NO2/c1-2-15-8-9-5-6-11(14)12-10(9)4-3-7-13-12/h3-7,14H,2,8H2,1H3
InChIKey
JQYCYUYNAZPXJQ-UHFFFAOYSA-N
Compound name
5-(ethoxymethyl)quinolin-8-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

22
Patents

203.09464 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.10192 143.0
[M+Na]+ 226.08386 152.0
[M-H]- 202.08736 145.1
[M+NH4]+ 221.12846 161.6
[M+K]+ 242.05780 148.6
[M+H-H2O]+ 186.09190 136.2
[M+HCOO]- 248.09284 164.1
[M+CH3COO]- 262.10849 184.1
[M+Na-2H]- 224.06931 151.1
[M]+ 203.09409 145.1
[M]- 203.09519 145.1
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

patents stripe