CID 22311263

N,n'-diethyl-1,3-bis(acrylamido)propane

Structural Information

Molecular Formula
C13H22N2O2
SMILES
CCN(CCCN(CC)C(=O)C=C)C(=O)C=C
InChI
InChI=1S/C13H22N2O2/c1-5-12(16)14(7-3)10-9-11-15(8-4)13(17)6-2/h5-6H,1-2,7-11H2,3-4H3
InChIKey
NCOOVOHQKQGDSY-UHFFFAOYSA-N
Compound name
N-ethyl-N-[3-[ethyl(prop-2-enoyl)amino]propyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

594
Patents

238.16812 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.17540 160.2
[M+Na]+ 261.15734 164.1
[M-H]- 237.16084 162.5
[M+NH4]+ 256.20194 178.5
[M+K]+ 277.13128 164.2
[M+H-H2O]+ 221.16538 153.5
[M+HCOO]- 283.16632 184.1
[M+CH3COO]- 297.18197 205.7
[M+Na-2H]- 259.14279 160.1
[M]+ 238.16757 163.7
[M]- 238.16867 163.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe