CID 54593119

(3-methanesulfonylbutan-2-yl)(methyl)amine

Structural Information

Molecular Formula
C6H15NO2S
SMILES
CC(C(C)S(=O)(=O)C)NC
InChI
InChI=1S/C6H15NO2S/c1-5(7-3)6(2)10(4,8)9/h5-7H,1-4H3
InChIKey
SFQYXJFZOHIBIU-UHFFFAOYSA-N
Compound name
N-methyl-3-methylsulfonylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.08235 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.08963 134.4
[M+Na]+ 188.07157 140.9
[M-H]- 164.07507 135.0
[M+NH4]+ 183.11617 155.2
[M+K]+ 204.04551 140.4
[M+H-H2O]+ 148.07961 129.6
[M+HCOO]- 210.08055 150.8
[M+CH3COO]- 224.09620 180.0
[M+Na-2H]- 186.05702 136.6
[M]+ 165.08180 136.5
[M]- 165.08290 136.5
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.