CID 43252224

2-(4-methanesulfonylpiperazin-1-yl)ethan-1-amine

Structural Information

Molecular Formula
C7H17N3O2S
SMILES
CS(=O)(=O)N1CCN(CC1)CCN
InChI
InChI=1S/C7H17N3O2S/c1-13(11,12)10-6-4-9(3-2-8)5-7-10/h2-8H2,1H3
InChIKey
DYVOXHLRPHXAEY-UHFFFAOYSA-N
Compound name
2-(4-methylsulfonylpiperazin-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

207.10414 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.11142 145.5
[M+Na]+ 230.09336 151.6
[M-H]- 206.09686 145.2
[M+NH4]+ 225.13796 161.6
[M+K]+ 246.06730 149.2
[M+H-H2O]+ 190.10140 138.6
[M+HCOO]- 252.10234 158.0
[M+CH3COO]- 266.11799 183.7
[M+Na-2H]- 228.07881 147.8
[M]+ 207.10359 143.1
[M]- 207.10469 143.1
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

patents stripe