CID 121553498

[1-(dimethylamino)cyclopropyl]methanesulfonyl chloride hydrochloride

Structural Information

Molecular Formula
C6H12ClNO2S
SMILES
CN(C)C1(CC1)CS(=O)(=O)Cl
InChI
InChI=1S/C6H12ClNO2S/c1-8(2)6(3-4-6)5-11(7,9)10/h3-5H2,1-2H3
InChIKey
AYRGULJGYUZGFQ-UHFFFAOYSA-N
Compound name
[1-(dimethylamino)cyclopropyl]methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.02773 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.03501 134.4
[M+Na]+ 220.01695 144.0
[M-H]- 196.02045 140.5
[M+NH4]+ 215.06155 152.3
[M+K]+ 235.99089 142.0
[M+H-H2O]+ 180.02499 130.7
[M+HCOO]- 242.02593 149.1
[M+CH3COO]- 256.04158 186.8
[M+Na-2H]- 218.00240 140.0
[M]+ 197.02718 142.1
[M]- 197.02828 142.1
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.