CID 110849241

N-(2-methoxyethyl)thiolane-2-carboxamide

Structural Information

Molecular Formula
C8H15NO2S
SMILES
COCCNC(=O)C1CCCS1
InChI
InChI=1S/C8H15NO2S/c1-11-5-4-9-8(10)7-3-2-6-12-7/h7H,2-6H2,1H3,(H,9,10)
InChIKey
LAUCTAVJOJPIDR-UHFFFAOYSA-N
Compound name
N-(2-methoxyethyl)thiolane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.08235 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.08963 142.9
[M+Na]+ 212.07157 147.9
[M-H]- 188.07507 145.9
[M+NH4]+ 207.11617 164.3
[M+K]+ 228.04551 146.8
[M+H-H2O]+ 172.07961 137.0
[M+HCOO]- 234.08055 160.8
[M+CH3COO]- 248.09620 181.1
[M+Na-2H]- 210.05702 143.3
[M]+ 189.08180 143.2
[M]- 189.08290 143.2
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.