CID 102608466

1445847-97-1

Structural Information

Molecular Formula
C4H7BF3O2
SMILES
[B-](COC1COC1)(F)(F)F
InChI
InChI=1S/C4H7BF3O2/c6-5(7,8)3-10-4-1-9-2-4/h4H,1-3H2/q-1
InChIKey
RBUBSLLSKBLSSS-UHFFFAOYSA-N
Compound name
trifluoro(oxetan-3-yloxymethyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.04912 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.056396 119.3
[M+Na]+ 178.038338 125.5
[M-H]- 154.041844 118.1
[M+NH4]+ 173.082943 132.0
[M+K]+ 194.012278 129.5
[M+H-H2O]+ 138.046380 109.9
[M+HCOO]- 200.047321 136.4
[M+CH3COO]- 214.062971 174.9
[M+Na-2H]- 176.023786 126.3
[M]+ 155.04857142 123.1
[M]- 155.04966858 123.1
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.