CID 21973189

3-(morpholin-4-yl)propane-1-sulfonyl chloride hydrochloride

Structural Information

Molecular Formula
C7H14ClNO3S
SMILES
C1COCCN1CCCS(=O)(=O)Cl
InChI
InChI=1S/C7H14ClNO3S/c8-13(10,11)7-1-2-9-3-5-12-6-4-9/h1-7H2
InChIKey
OSHRZGQSJOAQKN-UHFFFAOYSA-N
Compound name
3-morpholin-4-ylpropane-1-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

113
Patents

227.0383 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.04558 145.0
[M+Na]+ 250.02752 151.7
[M-H]- 226.03102 147.4
[M+NH4]+ 245.07212 161.6
[M+K]+ 266.00146 149.8
[M+H-H2O]+ 210.03556 139.8
[M+HCOO]- 272.03650 153.6
[M+CH3COO]- 286.05215 181.5
[M+Na-2H]- 248.01297 149.3
[M]+ 227.03775 147.2
[M]- 227.03885 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

patents stripe