CID 53403968

2503208-94-2

Structural Information

Molecular Formula
C9H10N2O3
SMILES
C1C(CN1)OC2=CC=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C9H10N2O3/c12-11(13)8-3-1-2-4-9(8)14-7-5-10-6-7/h1-4,7,10H,5-6H2
InChIKey
GQHOCWKTNHUTFL-UHFFFAOYSA-N
Compound name
3-(2-nitrophenoxy)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.06914 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.07642 137.4
[M+Na]+ 217.05836 145.3
[M+NH4]+ 212.10296 141.2
[M+K]+ 233.03230 144.5
[M-H]- 193.06186 138.0
[M+Na-2H]- 215.04381 141.7
[M]+ 194.06859 137.2
[M]- 194.06969 137.2
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

No patent data available for this compound.