CID 3079262

3-thiazolidinepropanamide, 2-propyl-

Structural Information

Molecular Formula
C9H18N2OS
SMILES
CCCC1N(CCS1)CCC(=O)N
InChI
InChI=1S/C9H18N2OS/c1-2-3-9-11(6-7-13-9)5-4-8(10)12/h9H,2-7H2,1H3,(H2,10,12)
InChIKey
GSPYFGAIWDRMBG-UHFFFAOYSA-N
Compound name
3-(2-propyl-1,3-thiazolidin-3-yl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.11398 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.12126 147.2
[M+Na]+ 225.10320 152.8
[M-H]- 201.10670 148.4
[M+NH4]+ 220.14780 166.8
[M+K]+ 241.07714 150.5
[M+H-H2O]+ 185.11124 140.7
[M+HCOO]- 247.11218 162.7
[M+CH3COO]- 261.12783 185.8
[M+Na-2H]- 223.08865 145.3
[M]+ 202.11343 146.5
[M]- 202.11453 146.5
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.