CID 129982013

1824145-86-9

Structural Information

Molecular Formula
C5H11NO3S
SMILES
CN1C(CCS1(=O)=O)CO
InChI
InChI=1S/C5H11NO3S/c1-6-5(4-7)2-3-10(6,8)9/h5,7H,2-4H2,1H3
InChIKey
GPEFZKYJMOJXNN-UHFFFAOYSA-N
Compound name
(2-methyl-1,1-dioxo-1,2-thiazolidin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.04596 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.053236 129.5
[M+Na]+ 188.035178 139.2
[M-H]- 164.038684 131.1
[M+NH4]+ 183.079783 152.7
[M+K]+ 204.009118 137.6
[M+H-H2O]+ 148.043220 125.6
[M+HCOO]- 210.044161 146.1
[M+CH3COO]- 224.059811 170.3
[M+Na-2H]- 186.020626 131.9
[M]+ 165.04541142 130.8
[M]- 165.04650858 130.8
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.