CID 96365

4-(2-nitrophenyl)morpholine

Structural Information

Molecular Formula
C10H12N2O3
SMILES
C1COCCN1C2=CC=CC=C2[N+](=O)[O-]
InChI
InChI=1S/C10H12N2O3/c13-12(14)10-4-2-1-3-9(10)11-5-7-15-8-6-11/h1-4H,5-8H2
InChIKey
WABXKOMDIQWGKF-UHFFFAOYSA-N
Compound name
4-(2-nitrophenyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

71
Patents

208.0848 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.09208 142.5
[M+Na]+ 231.07402 156.0
[M+NH4]+ 226.11862 150.9
[M+K]+ 247.04796 152.6
[M-H]- 207.07752 148.6
[M+Na-2H]- 229.05947 149.7
[M]+ 208.08425 146.0
[M]- 208.08535 146.0
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