CID 145915568

2416056-42-1

Structural Information

Molecular Formula
C7H9BF5O
SMILES
[B-](C1C2(C1(F)F)CCOCC2)(F)(F)F
InChI
InChI=1S/C7H9BF5O/c9-7(10)5(8(11,12)13)6(7)1-3-14-4-2-6/h5H,1-4H2/q-1
InChIKey
UXRJXDKJHINGPG-UHFFFAOYSA-N
Compound name
(2,2-difluoro-6-oxaspiro[2.5]octan-1-yl)-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.06667 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.07395 132.2
[M+Na]+ 238.05589 141.8
[M-H]- 214.05939 131.8
[M+NH4]+ 233.10049 148.2
[M+K]+ 254.02983 141.8
[M+H-H2O]+ 198.06393 126.2
[M+HCOO]- 260.06487 144.4
[M+CH3COO]- 274.08052 184.9
[M+Na-2H]- 236.04134 138.8
[M]+ 215.06612 124.3
[M]- 215.06722 124.3
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.