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]+ 190.089626 142.9
[M+Na]+ 212.071568 147.9
[M-H]- 188.075074 145.9
[M+NH4]+ 207.116173 164.3
[M+K]+ 228.045508 146.8
[M+H-H2O]+ 172.079610 137.0
[M+HCOO]- 234.080551 160.8
[M+CH3COO]- 248.096201 181.1
[M+Na-2H]- 210.057016 143.3
[M]+ 189.08180142 143.2
[M]- 189.08289858 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.