CID 14026398

116452-89-2

Structural Information

Molecular Formula
C7H9N3O3
SMILES
CCOC(=O)C1(CC1)C(=O)N=[N+]=[N-]
InChI
InChI=1S/C7H9N3O3/c1-2-13-6(12)7(3-4-7)5(11)9-10-8/h2-4H2,1H3
InChIKey
RZOJQLQNOXADQP-UHFFFAOYSA-N
Compound name
ethyl 1-carbonazidoylcyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.06439 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.071666 134.4
[M+Na]+ 206.053608 142.7
[M-H]- 182.057114 141.8
[M+NH4]+ 201.098213 151.3
[M+K]+ 222.027548 138.1
[M+H-H2O]+ 166.061650 133.8
[M+HCOO]- 228.062591 163.5
[M+CH3COO]- 242.078241 185.3
[M+Na-2H]- 204.039056 143.8
[M]+ 183.06384142 136.8
[M]- 183.06493858 136.8
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

No patent data available for this compound.