CID 16683025

Disodium;2-[9-(carboxylatomethyl)-4,11-dioxo-1,3-dioxa-6,9-diaza-2lambda2-plumbacycloundec-6-yl]acetate

Structural Information

Molecular Formula
C10H14N2O8Pb
SMILES
C1CN(CC(=O)O[Pb]OC(=O)CN1CC(=O)O)CC(=O)O
InChI
InChI=1S/C10H16N2O8.Pb/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);/q;+2/p-2
InChIKey
DSNDFKZAOUSNTQ-UHFFFAOYSA-L
Compound name
2-[9-(carboxymethyl)-4,11-dioxo-1,3-dioxa-6,9-diaza-2lambda2-plumbacycloundec-6-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

498.05167 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 499.05895 192.6
[M+Na]+ 521.04089 197.6
[M+NH4]+ 516.08549 192.0
[M+K]+ 537.01483 196.8
[M-H]- 497.04439 189.9
[M+Na-2H]- 519.02634 188.1
[M]+ 498.05112 191.3
[M]- 498.05222 191.3
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

No patent data available for this compound.