CID 82417805

2375273-76-8

Structural Information

Molecular Formula
C5H8N2OS
SMILES
C1=C(N=CS1)C(CO)N
InChI
InChI=1S/C5H8N2OS/c6-4(1-8)5-2-9-3-7-5/h2-4,8H,1,6H2
InChIKey
UEOYKJSIIHRAIQ-UHFFFAOYSA-N
Compound name
2-amino-2-(1,3-thiazol-4-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.03574 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.043016 127.3
[M+Na]+ 167.024958 135.2
[M-H]- 143.028464 128.2
[M+NH4]+ 162.069563 148.5
[M+K]+ 182.998898 133.1
[M+H-H2O]+ 127.033000 121.4
[M+HCOO]- 189.033941 145.4
[M+CH3COO]- 203.049591 170.2
[M+Na-2H]- 165.010406 129.5
[M]+ 144.03519142 126.4
[M]- 144.03628858 126.4
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

No patent data available for this compound.