CID 10307870

56610-81-2

Structural Information

Molecular Formula
C3H6N4OS
SMILES
C(CO)N1C(=S)N=NN1
InChI
InChI=1S/C3H6N4OS/c8-2-1-7-3(9)4-5-6-7/h8H,1-2H2,(H,4,6,9)
InChIKey
YKYUEQRWYGVUKB-UHFFFAOYSA-N
Compound name
1-(2-hydroxyethyl)-2H-tetrazole-5-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

165
Patents

146.02623 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.03351 126.7
[M+Na]+ 169.01545 137.7
[M-H]- 145.01895 123.3
[M+NH4]+ 164.06005 144.1
[M+K]+ 184.98939 134.3
[M+H-H2O]+ 129.02349 120.0
[M+HCOO]- 191.02443 141.1
[M+CH3COO]- 205.04008 165.7
[M+Na-2H]- 167.00090 129.7
[M]+ 146.02568 126.8
[M]- 146.02678 126.8
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