CID 6432976

Bis(2-(dimethylamino)ethyl) maleate

Structural Information

Molecular Formula
C12H22N2O4
SMILES
CN(C)CCOC(=O)/C=C\C(=O)OCCN(C)C
InChI
InChI=1S/C12H22N2O4/c1-13(2)7-9-17-11(15)5-6-12(16)18-10-8-14(3)4/h5-6H,7-10H2,1-4H3/b6-5-
InChIKey
HAHZVQOXFHJPOX-WAYWQWQTSA-N
Compound name
bis[2-(dimethylamino)ethyl] (Z)-but-2-enedioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

258.15796 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.165236 162.6
[M+Na]+ 281.147178 166.5
[M-H]- 257.150684 165.0
[M+NH4]+ 276.191783 180.1
[M+K]+ 297.121118 168.6
[M+H-H2O]+ 241.155220 155.6
[M+HCOO]- 303.156161 187.1
[M+CH3COO]- 317.171811 207.0
[M+Na-2H]- 279.132626 163.2
[M]+ 258.15741142 169.3
[M]- 258.15850858 169.3
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