CID 43350804

2-(3,4-difluorophenyl)morpholine

Structural Information

Molecular Formula
C10H11F2NO
SMILES
C1COC(CN1)C2=CC(=C(C=C2)F)F
InChI
InChI=1S/C10H11F2NO/c11-8-2-1-7(5-9(8)12)10-6-13-3-4-14-10/h1-2,5,10,13H,3-4,6H2
InChIKey
VPRWAYIZWAKYTD-UHFFFAOYSA-N
Compound name
2-(3,4-difluorophenyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

199.08087 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.088146 140.6
[M+Na]+ 222.070088 147.6
[M-H]- 198.073594 142.3
[M+NH4]+ 217.114693 156.4
[M+K]+ 238.044028 144.8
[M+H-H2O]+ 182.078130 131.6
[M+HCOO]- 244.079071 156.4
[M+CH3COO]- 258.094721 180.7
[M+Na-2H]- 220.055536 145.5
[M]+ 199.08032142 133.3
[M]- 199.08141858 133.3
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