CID 59103378

Azido-peg6-acid

Structural Information

Molecular Formula
C15H29N3O8
SMILES
C(COCCOCCOCCOCCOCCOCCN=[N+]=[N-])C(=O)O
InChI
InChI=1S/C15H29N3O8/c16-18-17-2-4-22-6-8-24-10-12-26-14-13-25-11-9-23-7-5-21-3-1-15(19)20/h1-14H2,(H,19,20)
InChIKey
KQYQHDQBMAJDRL-UHFFFAOYSA-N
Compound name
3-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

379.19547 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 380.20275 218.3
[M+Na]+ 402.18469 226.9
[M-H]- 378.18819 217.1
[M+NH4]+ 397.22929 222.2
[M+K]+ 418.15863 218.1
[M+H-H2O]+ 362.19273 211.1
[M+HCOO]- 424.19367 233.0
[M+CH3COO]- 438.20932 217.5
[M+Na-2H]- 400.17014 207.6
[M]+ 379.19492 211.8
[M]- 379.19602 211.8
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

patents stripe