CID 18759534

356046-26-9

Structural Information

Molecular Formula
C12H24N6O5
SMILES
C(COCCOCCOCCOCCOCCN=[N+]=[N-])N=[N+]=[N-]
InChI
InChI=1S/C12H24N6O5/c13-17-15-1-3-19-5-7-21-9-11-23-12-10-22-8-6-20-4-2-16-18-14/h1-12H2
InChIKey
OQHIMLOZSDFRID-UHFFFAOYSA-N
Compound name
1-azido-2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

81
Patents

332.18082 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.18810 194.5
[M+Na]+ 355.17004 198.3
[M+NH4]+ 350.21464 201.3
[M+K]+ 371.14398 206.6
[M-H]- 331.17354 188.4
[M+Na-2H]- 353.15549 188.5
[M]+ 332.18027 194.8
[M]- 332.18137 194.8
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