CID 445279

(1s,2s)-1-amino-1-(1,3-thiazol-2-yl)propan-2-ol

Structural Information

Molecular Formula
C6H10N2OS
SMILES
C[C@H]([C@@H](C1=NC=CS1)N)O
InChI
InChI=1S/C6H10N2OS/c1-4(9)5(7)6-8-2-3-10-6/h2-5,9H,7H2,1H3/t4-,5+/m1/s1
InChIKey
QWDNYLFSFTUIKH-UHNVWZDZSA-N
Compound name
(1S,2R)-1-amino-1-(1,3-thiazol-2-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.05139 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.05867 132.5
[M+Na]+ 181.04061 139.6
[M-H]- 157.04411 133.4
[M+NH4]+ 176.08521 153.1
[M+K]+ 197.01455 137.8
[M+H-H2O]+ 141.04865 126.5
[M+HCOO]- 203.04959 149.2
[M+CH3COO]- 217.06524 174.1
[M+Na-2H]- 179.02606 133.1
[M]+ 158.05084 131.4
[M]- 158.05194 131.4
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.