CID 208536

Benzenesulfonamide, n-(3-dimethylaminopropyl)-p-isopropoxy-

Structural Information

Molecular Formula
C14H24N2O3S
SMILES
CC(C)OC1=CC=C(C=C1)S(=O)(=O)NCCCN(C)C
InChI
InChI=1S/C14H24N2O3S/c1-12(2)19-13-6-8-14(9-7-13)20(17,18)15-10-5-11-16(3)4/h6-9,12,15H,5,10-11H2,1-4H3
InChIKey
HWSUPEFUHXHFFT-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-4-propan-2-yloxybenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.15076 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.15804 169.9
[M+Na]+ 323.13998 174.6
[M-H]- 299.14348 174.3
[M+NH4]+ 318.18458 185.4
[M+K]+ 339.11392 172.9
[M+H-H2O]+ 283.14802 162.2
[M+HCOO]- 345.14896 188.2
[M+CH3COO]- 359.16461 210.2
[M+Na-2H]- 321.12543 171.6
[M]+ 300.15021 175.4
[M]- 300.15131 175.4
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.