CID 45079493

5,6,7,8-tetrahydroquinolin-3-ol

Structural Information

Molecular Formula
C9H11NO
SMILES
C1CCC2=C(C1)C=C(C=N2)O
InChI
InChI=1S/C9H11NO/c11-8-5-7-3-1-2-4-9(7)10-6-8/h5-6,11H,1-4H2
InChIKey
PSXNUQKAJHVAPG-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydroquinolin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

149.08406 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.091336 129.0
[M+Na]+ 172.073278 136.4
[M-H]- 148.076784 130.6
[M+NH4]+ 167.117883 149.4
[M+K]+ 188.047218 133.6
[M+H-H2O]+ 132.081320 122.9
[M+HCOO]- 194.082261 148.1
[M+CH3COO]- 208.097911 141.9
[M+Na-2H]- 170.058726 137.5
[M]+ 149.08351142 125.3
[M]- 149.08460858 125.3
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