CID 82275566

6-chloro-1,2,3,4-tetrahydroquinolin-4-ol

Structural Information

Molecular Formula
C9H10ClNO
SMILES
C1CNC2=C(C1O)C=C(C=C2)Cl
InChI
InChI=1S/C9H10ClNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-2,5,9,11-12H,3-4H2
InChIKey
CTGXTNYVBXBBFN-UHFFFAOYSA-N
Compound name
6-chloro-1,2,3,4-tetrahydroquinolin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

183.04509 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.052366 135.3
[M+Na]+ 206.034308 144.0
[M-H]- 182.037814 135.6
[M+NH4]+ 201.078913 154.7
[M+K]+ 222.008248 138.5
[M+H-H2O]+ 166.042350 130.4
[M+HCOO]- 228.043291 148.3
[M+CH3COO]- 242.058941 147.5
[M+Na-2H]- 204.019756 142.1
[M]+ 183.04454142 132.2
[M]- 183.04563858 132.2
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

patents stripe