CID 135690274

5-quinoxalinol

Structural Information

Molecular Formula
C8H6N2O
SMILES
C1=CC2=NC=CN=C2C(=C1)O
InChI
InChI=1S/C8H6N2O/c11-7-3-1-2-6-8(7)10-5-4-9-6/h1-5,11H
InChIKey
ZUQDDQFXSNXEOD-UHFFFAOYSA-N
Compound name
quinoxalin-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

800
Patents

146.04802 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.05530 126.2
[M+Na]+ 169.03724 136.2
[M-H]- 145.04074 127.2
[M+NH4]+ 164.08184 145.5
[M+K]+ 185.01118 132.9
[M+H-H2O]+ 129.04528 119.3
[M+HCOO]- 191.04622 147.2
[M+CH3COO]- 205.06187 139.9
[M+Na-2H]- 167.02269 137.3
[M]+ 146.04747 125.6
[M]- 146.04857 125.6
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