CID 10845705

59559-06-7

Structural Information

Molecular Formula
C6H12N6O2
SMILES
C(COCCOCCN=[N+]=[N-])N=[N+]=[N-]
InChI
InChI=1S/C6H12N6O2/c7-11-9-1-3-13-5-6-14-4-2-10-12-8/h1-6H2
InChIKey
OHZGAFKSAANFAS-UHFFFAOYSA-N
Compound name
1-azido-2-[2-(2-azidoethoxy)ethoxy]ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

148
Patents

200.10217 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.10945 140.2
[M+Na]+ 223.09139 144.5
[M-H]- 199.09489 145.1
[M+NH4]+ 218.13599 230.1
[M+K]+ 239.06533 137.0
[M+H-H2O]+ 183.09943 141.2
[M+HCOO]- 245.10037 249.1
[M+CH3COO]- 259.11602 193.1
[M+Na-2H]- 221.07684 153.4
[M]+ 200.10162 139.7
[M]- 200.10272 139.7
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