CID 119030882

3-(2,2-difluoroethyl)morpholine

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1COCC(N1)CC(F)F
InChI
InChI=1S/C6H11F2NO/c7-6(8)3-5-4-10-2-1-9-5/h5-6,9H,1-4H2
InChIKey
SLBJBODOVHXGPG-UHFFFAOYSA-N
Compound name
3-(2,2-difluoroethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

151.08087 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.08815 130.3
[M+Na]+ 174.07009 135.2
[M-H]- 150.07359 128.1
[M+NH4]+ 169.11469 147.6
[M+K]+ 190.04403 134.8
[M+H-H2O]+ 134.07813 122.3
[M+HCOO]- 196.07907 144.8
[M+CH3COO]- 210.09472 171.6
[M+Na-2H]- 172.05554 135.0
[M]+ 151.08032 122.4
[M]- 151.08142 122.4
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