CID 59414219

1051463-24-1

Structural Information

Molecular Formula
C8H14N2OS
SMILES
CC(C)(C1=NC(=CS1)CNC)O
InChI
InChI=1S/C8H14N2OS/c1-8(2,11)7-10-6(4-9-3)5-12-7/h5,9,11H,4H2,1-3H3
InChIKey
QXDSMGBSRJCUTJ-UHFFFAOYSA-N
Compound name
2-[4-(methylaminomethyl)-1,3-thiazol-2-yl]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

186.08269 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08997 141.0
[M+Na]+ 209.07191 149.1
[M-H]- 185.07541 142.5
[M+NH4]+ 204.11651 161.3
[M+K]+ 225.04585 146.5
[M+H-H2O]+ 169.07995 135.4
[M+HCOO]- 231.08089 158.2
[M+CH3COO]- 245.09654 180.5
[M+Na-2H]- 207.05736 143.9
[M]+ 186.08214 142.7
[M]- 186.08324 142.7
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