CID 12629706

5,6,7,8-tetrahydroquinoxalin-5-ol

Structural Information

Molecular Formula
C8H10N2O
SMILES
C1CC(C2=NC=CN=C2C1)O
InChI
InChI=1S/C8H10N2O/c11-7-3-1-2-6-8(7)10-5-4-9-6/h4-5,7,11H,1-3H2
InChIKey
LYSCEKSEDXBGNS-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydroquinoxalin-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

150.07932 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08660 129.6
[M+Na]+ 173.06854 137.4
[M-H]- 149.07204 129.8
[M+NH4]+ 168.11314 148.5
[M+K]+ 189.04248 134.7
[M+H-H2O]+ 133.07658 122.6
[M+HCOO]- 195.07752 147.6
[M+CH3COO]- 209.09317 142.1
[M+Na-2H]- 171.05399 138.5
[M]+ 150.07877 126.1
[M]- 150.07987 126.1
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