CID 4175978

92377-71-4

Structural Information

Molecular Formula
C14H24N2O6
SMILES
CCOC(=O)CNC(=O)CCCCC(=O)NCC(=O)OCC
InChI
InChI=1S/C14H24N2O6/c1-3-21-13(19)9-15-11(17)7-5-6-8-12(18)16-10-14(20)22-4-2/h3-10H2,1-2H3,(H,15,17)(H,16,18)
InChIKey
FQLCHRFTRNMPOC-UHFFFAOYSA-N
Compound name
ethyl 2-[[6-[(2-ethoxy-2-oxoethyl)amino]-6-oxohexanoyl]amino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.16342 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.170696 175.3
[M+Na]+ 339.152638 177.5
[M-H]- 315.156144 174.3
[M+NH4]+ 334.197243 188.7
[M+K]+ 355.126578 178.0
[M+H-H2O]+ 299.160680 167.9
[M+HCOO]- 361.161621 196.8
[M+CH3COO]- 375.177271 210.7
[M+Na-2H]- 337.138086 174.1
[M]+ 316.16287142 180.8
[M]- 316.16396858 180.8
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.