CID 89836102

6,6-difluoro-1-oxaspiro[2.5]octane

Structural Information

Molecular Formula
C7H10F2O
SMILES
C1CC(CCC12CO2)(F)F
InChI
InChI=1S/C7H10F2O/c8-7(9)3-1-6(2-4-7)5-10-6/h1-5H2
InChIKey
VINRUNPQHUYDTJ-UHFFFAOYSA-N
Compound name
6,6-difluoro-1-oxaspiro[2.5]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

148.06998 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.07726 126.8
[M+Na]+ 171.05920 136.1
[M-H]- 147.06270 131.8
[M+NH4]+ 166.10380 145.9
[M+K]+ 187.03314 137.2
[M+H-H2O]+ 131.06724 120.6
[M+HCOO]- 193.06818 144.4
[M+CH3COO]- 207.08383 175.8
[M+Na-2H]- 169.04465 135.8
[M]+ 148.06943 124.4
[M]- 148.07053 124.4
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