CID 2737507

Methyl thiazolidine-2-carboxylate hydrochloride

Structural Information

Molecular Formula
C5H9NO2S
SMILES
COC(=O)C1NCCS1
InChI
InChI=1S/C5H9NO2S/c1-8-5(7)4-6-2-3-9-4/h4,6H,2-3H2,1H3
InChIKey
IEYXUDKJVHYWOM-UHFFFAOYSA-N
Compound name
methyl 1,3-thiazolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

147.0354 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.04268 130.2
[M+Na]+ 170.02462 137.1
[M-H]- 146.02812 131.0
[M+NH4]+ 165.06922 151.7
[M+K]+ 185.99856 136.0
[M+H-H2O]+ 130.03266 124.8
[M+HCOO]- 192.03360 145.5
[M+CH3COO]- 206.04925 167.3
[M+Na-2H]- 168.01007 130.9
[M]+ 147.03485 128.9
[M]- 147.03595 128.9
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