CID 98091792

En300-1612226

Structural Information

Molecular Formula
C6H12ClNO3S
SMILES
COC[C@H]1CCCN1S(=O)(=O)Cl
InChI
InChI=1S/C6H12ClNO3S/c1-11-5-6-3-2-4-8(6)12(7,9)10/h6H,2-5H2,1H3/t6-/m1/s1
InChIKey
ZLZQXGXZMQYGDJ-ZCFIWIBFSA-N
Compound name
(2R)-2-(methoxymethyl)pyrrolidine-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.02264 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.02992 143.3
[M+Na]+ 236.01186 152.3
[M-H]- 212.01536 145.9
[M+NH4]+ 231.05646 163.9
[M+K]+ 251.98580 149.8
[M+H-H2O]+ 196.01990 138.9
[M+HCOO]- 258.02084 155.0
[M+CH3COO]- 272.03649 179.3
[M+Na-2H]- 233.99731 145.0
[M]+ 213.02209 147.2
[M]- 213.02319 147.2
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.