CID 22731907

Azido-peg4-c2-carboxylic acid

Structural Information

Molecular Formula
C11H21N3O6
SMILES
C(COCCOCCOCCOCCN=[N+]=[N-])C(=O)O
InChI
InChI=1S/C11H21N3O6/c12-14-13-2-4-18-6-8-20-10-9-19-7-5-17-3-1-11(15)16/h1-10H2,(H,15,16)
InChIKey
BODPHGOBXPGJKO-UHFFFAOYSA-N
Compound name
3-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

120
Patents

291.14304 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.15032 164.3
[M+Na]+ 314.13226 167.2
[M-H]- 290.13576 164.7
[M+NH4]+ 309.17686 202.5
[M+K]+ 330.10620 163.2
[M+H-H2O]+ 274.14030 161.0
[M+HCOO]- 336.14124 216.3
[M+CH3COO]- 350.15689 201.5
[M+Na-2H]- 312.11771 171.3
[M]+ 291.14249 170.3
[M]- 291.14359 170.3
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