CID 77939

4255-94-1

Structural Information

Molecular Formula
C14H20N3O3
SMILES
CCOC1=CC(=C(C=C1[N+]#N)OCC)N2CCOCC2
InChI
InChI=1S/C14H20N3O3/c1-3-19-13-10-12(17-5-7-18-8-6-17)14(20-4-2)9-11(13)16-15/h9-10H,3-8H2,1-2H3/q+1
InChIKey
HRWJUSVKPYSOSI-UHFFFAOYSA-N
Compound name
2,5-diethoxy-4-morpholin-4-ylbenzenediazonium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

97
Patents

278.15045 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.15773 161.2
[M+Na]+ 301.13967 168.9
[M-H]- 277.14317 166.5
[M+NH4]+ 296.18427 173.0
[M+K]+ 317.11361 162.3
[M+H-H2O]+ 261.14771 148.1
[M+HCOO]- 323.14865 178.3
[M+CH3COO]- 337.16430 207.9
[M+Na-2H]- 299.12512 167.7
[M]+ 278.14990 156.9
[M]- 278.15100 156.9
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