CID 13637184

105773-93-1

Structural Information

Molecular Formula
C5H8N2OS
SMILES
C1=C(SC(=N1)N)CCO
InChI
InChI=1S/C5H8N2OS/c6-5-7-3-4(9-5)1-2-8/h3,8H,1-2H2,(H2,6,7)
InChIKey
QXZROQLPDVYROK-UHFFFAOYSA-N
Compound name
2-(2-amino-1,3-thiazol-5-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

144.03574 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.04302 127.3
[M+Na]+ 167.02496 136.9
[M+NH4]+ 162.06956 135.7
[M+K]+ 182.99890 131.9
[M-H]- 143.02846 128.3
[M+Na-2H]- 165.01041 131.6
[M]+ 144.03519 129.1
[M]- 144.03629 129.1
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