CID 3050027

Benzenesulfonamide, 4-amino-5-chloro-n-(3-(diethylamino)propyl)-2-methoxy-n-methyl-, monohydrochloride

Structural Information

Molecular Formula
C15H26ClN3O3S
SMILES
CCN(CC)CCCN(C)S(=O)(=O)C1=C(C=C(C(=C1)Cl)N)OC
InChI
InChI=1S/C15H26ClN3O3S/c1-5-19(6-2)9-7-8-18(3)23(20,21)15-10-12(16)13(17)11-14(15)22-4/h10-11H,5-9,17H2,1-4H3
InChIKey
QUWLMTDGSVGTKU-UHFFFAOYSA-N
Compound name
4-amino-5-chloro-N-[3-(diethylamino)propyl]-2-methoxy-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.13834 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.14562 184.4
[M+Na]+ 386.12756 190.4
[M-H]- 362.13106 190.1
[M+NH4]+ 381.17216 198.8
[M+K]+ 402.10150 187.4
[M+H-H2O]+ 346.13560 177.4
[M+HCOO]- 408.13654 199.6
[M+CH3COO]- 422.15219 226.2
[M+Na-2H]- 384.11301 183.9
[M]+ 363.13779 193.1
[M]- 363.13889 193.1
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

No patent data available for this compound.