CID 10384719

N-[2-(dansylamino)ethyl]maleimide

Structural Information

Molecular Formula
C18H19N3O4S
SMILES
CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NCCN3C(=O)C=CC3=O
InChI
InChI=1S/C18H19N3O4S/c1-20(2)15-7-3-6-14-13(15)5-4-8-16(14)26(24,25)19-11-12-21-17(22)9-10-18(21)23/h3-10,19H,11-12H2,1-2H3
InChIKey
GFVSIWWKMOVBJL-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-N-[2-(2,5-dioxopyrrol-1-yl)ethyl]naphthalene-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

373.10962 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.116896 185.8
[M+Na]+ 396.098838 193.7
[M-H]- 372.102344 193.9
[M+NH4]+ 391.143443 200.0
[M+K]+ 412.072778 189.8
[M+H-H2O]+ 356.106880 178.1
[M+HCOO]- 418.107821 203.9
[M+CH3COO]- 432.123471 221.9
[M+Na-2H]- 394.084286 188.3
[M]+ 373.10907142 191.2
[M]- 373.11016858 191.2
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