CID 2727858

N,n'-(1,6-dioxo-1,6-hexanediyl)bisglycine

Structural Information

Molecular Formula
C10H16N2O6
SMILES
C(CCC(=O)NCC(=O)O)CC(=O)NCC(=O)O
InChI
InChI=1S/C10H16N2O6/c13-7(11-5-9(15)16)3-1-2-4-8(14)12-6-10(17)18/h1-6H2,(H,11,13)(H,12,14)(H,15,16)(H,17,18)
InChIKey
GOKWUADLSJKZAA-UHFFFAOYSA-N
Compound name
2-[[6-(carboxymethylamino)-6-oxohexanoyl]amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

260.10083 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.10811 158.9
[M+Na]+ 283.09005 161.8
[M+NH4]+ 278.13465 160.6
[M+K]+ 299.06399 161.6
[M-H]- 259.09355 153.5
[M+Na-2H]- 281.07550 156.3
[M]+ 260.10028 156.6
[M]- 260.10138 156.6
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

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