CID 45121757

908269-56-7

Structural Information

Molecular Formula
C6H10N2OS
SMILES
CC(C)(C1=CN=C(S1)N)O
InChI
InChI=1S/C6H10N2OS/c1-6(2,9)4-3-8-5(7)10-4/h3,9H,1-2H3,(H2,7,8)
InChIKey
FLVKNCHWZGPGMX-UHFFFAOYSA-N
Compound name
2-(2-amino-1,3-thiazol-5-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

75
Patents

158.05139 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.058666 132.4
[M+Na]+ 181.040608 141.4
[M-H]- 157.044114 133.7
[M+NH4]+ 176.085213 153.5
[M+K]+ 197.014548 138.9
[M+H-H2O]+ 141.048650 127.2
[M+HCOO]- 203.049591 149.6
[M+CH3COO]- 217.065241 173.8
[M+Na-2H]- 179.026056 135.3
[M]+ 158.05084142 132.3
[M]- 158.05193858 132.3
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

patents stripe