CID 95447662

2839128-65-1

Structural Information

Molecular Formula
C11H14ClNO2
SMILES
C1COC[C@@H](N1)COC2=CC=C(C=C2)Cl
InChI
InChI=1S/C11H14ClNO2/c12-9-1-3-11(4-2-9)15-8-10-7-14-6-5-13-10/h1-4,10,13H,5-8H2/t10-/m1/s1
InChIKey
RXMMCVACESECCS-SNVBAGLBSA-N
Compound name
(3R)-3-[(4-chlorophenoxy)methyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.0713 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.07858 148.4
[M+Na]+ 250.06052 154.4
[M-H]- 226.06402 151.9
[M+NH4]+ 245.10512 163.5
[M+K]+ 266.03446 151.1
[M+H-H2O]+ 210.06856 141.2
[M+HCOO]- 272.06950 161.5
[M+CH3COO]- 286.08515 183.0
[M+Na-2H]- 248.04597 154.1
[M]+ 227.07075 146.6
[M]- 227.07185 146.6
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.