CID 3025493

Brn 5770815

Structural Information

Molecular Formula
C15H24N2O6S
SMILES
COC1=C(C(=C(C=C1)S(=O)(=O)NCCN2CCOCC2)OC)OC
InChI
InChI=1S/C15H24N2O6S/c1-20-12-4-5-13(15(22-3)14(12)21-2)24(18,19)16-6-7-17-8-10-23-11-9-17/h4-5,16H,6-11H2,1-3H3
InChIKey
GAUPAAGWGWCMBV-UHFFFAOYSA-N
Compound name
2,3,4-trimethoxy-N-(2-morpholin-4-ylethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.1355 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.14278 180.6
[M+Na]+ 383.12472 185.5
[M-H]- 359.12822 185.9
[M+NH4]+ 378.16932 190.5
[M+K]+ 399.09866 184.6
[M+H-H2O]+ 343.13276 172.0
[M+HCOO]- 405.13370 194.1
[M+CH3COO]- 419.14935 212.8
[M+Na-2H]- 381.11017 183.5
[M]+ 360.13495 186.1
[M]- 360.13605 186.1
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.