CID 167720855

{6,6-difluorobicyclo[3.1.0]hexan-1-yl}methanol

Structural Information

Molecular Formula
C7H10F2O
SMILES
C1CC2C(C1)(C2(F)F)CO
InChI
InChI=1S/C7H10F2O/c8-7(9)5-2-1-3-6(5,7)4-10/h5,10H,1-4H2
InChIKey
HKYGJVRERQECRJ-UHFFFAOYSA-N
Compound name
(6,6-difluoro-1-bicyclo[3.1.0]hexanyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

148.06998 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.07726 125.0
[M+Na]+ 171.05920 136.1
[M-H]- 147.06270 127.1
[M+NH4]+ 166.10380 147.3
[M+K]+ 187.03314 133.8
[M+H-H2O]+ 131.06724 120.6
[M+HCOO]- 193.06818 143.6
[M+CH3COO]- 207.08383 175.3
[M+Na-2H]- 169.04465 132.1
[M]+ 148.06943 124.5
[M]- 148.07053 124.5
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.