CID 155858419

En300-27716743

Structural Information

Molecular Formula
C10H13BF5
SMILES
[B-](CC1CC2(C1)C3(C2(F)F)CCC3)(F)(F)F
InChI
InChI=1S/C10H13BF5/c12-10(13)8(2-1-3-8)9(10)4-7(5-9)6-11(14,15)16/h7H,1-6H2/q-1
InChIKey
VSWVZNZKEZVTFO-UHFFFAOYSA-N
Compound name
(9,9-difluorodispiro[3.0.35.14]nonan-7-yl)methyl-trifluoroboranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.10304 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.11032 140.6
[M+Na]+ 262.09226 148.6
[M-H]- 238.09576 142.5
[M+NH4]+ 257.13686 147.2
[M+K]+ 278.06620 151.1
[M+H-H2O]+ 222.10030 130.0
[M+HCOO]- 284.10124 151.5
[M+CH3COO]- 298.11689 202.8
[M+Na-2H]- 260.07771 145.3
[M]+ 239.10249 149.9
[M]- 239.10359 149.9
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.