CID 15105543

2-chloro-3-methoxyquinoline

Structural Information

Molecular Formula
C10H8ClNO
SMILES
COC1=CC2=CC=CC=C2N=C1Cl
InChI
InChI=1S/C10H8ClNO/c1-13-9-6-7-4-2-3-5-8(7)12-10(9)11/h2-6H,1H3
InChIKey
ASFQNJGPOSEULR-UHFFFAOYSA-N
Compound name
2-chloro-3-methoxyquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

193.02943 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.03671 135.7
[M+Na]+ 216.01865 152.6
[M+NH4]+ 211.06325 146.1
[M+K]+ 231.99259 143.9
[M-H]- 192.02215 139.2
[M+Na-2H]- 214.00410 144.8
[M]+ 193.02888 139.7
[M]- 193.02998 139.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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