CID 137944856

2287312-36-9

Structural Information

Molecular Formula
C4H9F2NO
SMILES
CC(CO)(C(F)F)N
InChI
InChI=1S/C4H9F2NO/c1-4(7,2-8)3(5)6/h3,8H,2,7H2,1H3
InChIKey
GYYMLBFAXQGQPU-UHFFFAOYSA-N
Compound name
2-amino-3,3-difluoro-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.06522 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.07250 122.7
[M+Na]+ 148.05444 129.7
[M-H]- 124.05794 118.8
[M+NH4]+ 143.09904 143.7
[M+K]+ 164.02838 129.1
[M+H-H2O]+ 108.06248 117.1
[M+HCOO]- 170.06342 141.6
[M+CH3COO]- 184.07907 171.2
[M+Na-2H]- 146.03989 127.6
[M]+ 125.06467 117.2
[M]- 125.06577 117.2
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.