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]+ 166.089626 134.4
[M+Na]+ 188.071568 140.9
[M-H]- 164.075074 135.0
[M+NH4]+ 183.116173 155.2
[M+K]+ 204.045508 140.4
[M+H-H2O]+ 148.079610 129.6
[M+HCOO]- 210.080551 150.8
[M+CH3COO]- 224.096201 180.0
[M+Na-2H]- 186.057016 136.6
[M]+ 165.08180142 136.5
[M]- 165.08289858 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.