CID 84716055

2305925-28-2

Structural Information

Molecular Formula
C4H9F2NO
SMILES
CNCCOC(F)F
InChI
InChI=1S/C4H9F2NO/c1-7-2-3-8-4(5)6/h4,7H,2-3H2,1H3
InChIKey
XKBWSWCFCLPUMX-UHFFFAOYSA-N
Compound name
2-(difluoromethoxy)-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

125.06522 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.07250 121.9
[M+Na]+ 148.05444 128.8
[M-H]- 124.05794 119.6
[M+NH4]+ 143.09904 143.7
[M+K]+ 164.02838 129.2
[M+H-H2O]+ 108.06248 115.3
[M+HCOO]- 170.06342 144.4
[M+CH3COO]- 184.07907 174.2
[M+Na-2H]- 146.03989 127.8
[M]+ 125.06467 119.9
[M]- 125.06577 119.9
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