CID 24377

Metalol hydrochloride

Structural Information

Molecular Formula
C11H18N2O3S
SMILES
CC(C(C1=CC=C(C=C1)NS(=O)(=O)C)O)NC
InChI
InChI=1S/C11H18N2O3S/c1-8(12-2)11(14)9-4-6-10(7-5-9)13-17(3,15)16/h4-8,11-14H,1-3H3
InChIKey
YTDJNWMSAAWJDD-UHFFFAOYSA-N
Compound name
N-[4-[1-hydroxy-2-(methylamino)propyl]phenyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

862
Patents

258.10382 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.11110 157.5
[M+Na]+ 281.09304 165.1
[M+NH4]+ 276.13764 163.4
[M+K]+ 297.06698 160.2
[M-H]- 257.09654 157.8
[M+Na-2H]- 279.07849 161.2
[M]+ 258.10327 158.7
[M]- 258.10437 158.7
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