CID 43131419

N-(3-methylbutan-2-yl)-1,3-thiazolidine-4-carboxamide hydrochloride

Structural Information

Molecular Formula
C9H18N2OS
SMILES
CC(C)C(C)NC(=O)C1CSCN1
InChI
InChI=1S/C9H18N2OS/c1-6(2)7(3)11-9(12)8-4-13-5-10-8/h6-8,10H,4-5H2,1-3H3,(H,11,12)
InChIKey
HHJNHEOVFJJSMH-UHFFFAOYSA-N
Compound name
N-(3-methylbutan-2-yl)-1,3-thiazolidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.11398 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.12126 148.9
[M+Na]+ 225.10320 152.6
[M-H]- 201.10670 149.1
[M+NH4]+ 220.14780 167.7
[M+K]+ 241.07714 150.9
[M+H-H2O]+ 185.11124 142.6
[M+HCOO]- 247.11218 161.5
[M+CH3COO]- 261.12783 183.9
[M+Na-2H]- 223.08865 146.0
[M]+ 202.11343 145.6
[M]- 202.11453 145.6
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.