CID 781248

3-hydrazino-2-quinoxalinethiol

Structural Information

Molecular Formula
C8H8N4S
SMILES
C1=CC=C2C(=C1)NC(=S)C(=N2)NN
InChI
InChI=1S/C8H8N4S/c9-12-7-8(13)11-6-4-2-1-3-5(6)10-7/h1-4H,9H2,(H,10,12)(H,11,13)
InChIKey
TVYAHCDRRICQJM-UHFFFAOYSA-N
Compound name
3-hydrazinyl-1H-quinoxaline-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

23
Patents

192.04697 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.05425 135.0
[M+Na]+ 215.03619 145.0
[M-H]- 191.03969 135.7
[M+NH4]+ 210.08079 152.4
[M+K]+ 231.01013 138.9
[M+H-H2O]+ 175.04423 128.4
[M+HCOO]- 237.04517 152.2
[M+CH3COO]- 251.06082 147.3
[M+Na-2H]- 213.02164 142.4
[M]+ 192.04642 132.6
[M]- 192.04752 132.6
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