CID 139022510

1612892-44-0

Structural Information

Molecular Formula
C8H13BF3O2
SMILES
[B-]([C@@H]1C[C@H]1C(=O)OC(C)(C)C)(F)(F)F
InChI
InChI=1S/C8H13BF3O2/c1-8(2,3)14-7(13)5-4-6(5)9(10,11)12/h5-6H,4H2,1-3H3/q-1/t5-,6-/m1/s1
InChIKey
KSZWLRCHYFBXJI-PHDIDXHHSA-N
Compound name
trifluoro-[(1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonyl]cyclopropyl]boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.09607 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.10335 153.8
[M+Na]+ 232.08529 160.2
[M+NH4]+ 227.12989 158.0
[M+K]+ 248.05923 159.5
[M-H]- 208.08879 154.2
[M+Na-2H]- 230.07074 155.8
[M]+ 209.09552 155.1
[M]- 209.09662 155.1
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.