CID 117327769

2-(2-chloro-6-methoxyphenyl)morpholine

Structural Information

Molecular Formula
C11H14ClNO2
SMILES
COC1=C(C(=CC=C1)Cl)C2CNCCO2
InChI
InChI=1S/C11H14ClNO2/c1-14-9-4-2-3-8(12)11(9)10-7-13-5-6-15-10/h2-4,10,13H,5-7H2,1H3
InChIKey
AEMPEATUDLEJMI-UHFFFAOYSA-N
Compound name
2-(2-chloro-6-methoxyphenyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.0713 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.07858 148.6
[M+Na]+ 250.06052 155.6
[M-H]- 226.06402 152.6
[M+NH4]+ 245.10512 164.1
[M+K]+ 266.03446 152.3
[M+H-H2O]+ 210.06856 141.7
[M+HCOO]- 272.06950 161.7
[M+CH3COO]- 286.08515 184.2
[M+Na-2H]- 248.04597 153.6
[M]+ 227.07075 147.2
[M]- 227.07185 147.2
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.