CID 108711

4-(2-chloro-4-nitrophenyl)morpholine

Structural Information

Molecular Formula
C10H11ClN2O3
SMILES
C1COCCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl
InChI
InChI=1S/C10H11ClN2O3/c11-9-7-8(13(14)15)1-2-10(9)12-3-5-16-6-4-12/h1-2,7H,3-6H2
InChIKey
ZPKGWYXJULKUEH-UHFFFAOYSA-N
Compound name
4-(2-chloro-4-nitrophenyl)morpholine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

82
Patents

242.04582 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.05310 150.9
[M+Na]+ 265.03504 156.8
[M-H]- 241.03854 156.1
[M+NH4]+ 260.07964 165.2
[M+K]+ 281.00898 150.6
[M+H-H2O]+ 225.04308 148.2
[M+HCOO]- 287.04402 166.6
[M+CH3COO]- 301.05967 183.4
[M+Na-2H]- 263.02049 157.9
[M]+ 242.04527 148.5
[M]- 242.04637 148.5
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