CID 14695233

(2,2-difluoro-1-methylcyclopropyl)methanol

Structural Information

Molecular Formula
C5H8F2O
SMILES
CC1(CC1(F)F)CO
InChI
InChI=1S/C5H8F2O/c1-4(3-8)2-5(4,6)7/h8H,2-3H2,1H3
InChIKey
LVSLCFWHJCUZNL-UHFFFAOYSA-N
Compound name
(2,2-difluoro-1-methylcyclopropyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

122.05432 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.061596 117.3
[M+Na]+ 145.043538 128.6
[M-H]- 121.047044 119.3
[M+NH4]+ 140.088143 138.1
[M+K]+ 161.017478 127.9
[M+H-H2O]+ 105.051580 113.0
[M+HCOO]- 167.052521 137.7
[M+CH3COO]- 181.068171 171.8
[M+Na-2H]- 143.028986 125.6
[M]+ 122.05377142 117.9
[M]- 122.05486858 117.9
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