CID 86278601

2-(1,2-dicarbaundecaboran(11)-1-yl)-n,n-diethylacetamide potassium salt

Structural Information

Molecular Formula
C8H14B9NO
SMILES
[B]1[B][B][B]B2[B]C(C2CC(=O)N(CC)CC)[B][B][B]1
InChI
InChI=1S/C8H14B9NO/c1-3-18(4-2)7(19)5-6-8-9-11-12-13-14-15-16-17(6)10-8/h6,8H,3-5H2,1-2H3
InChIKey
HKCLHEKEVGVNED-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.19128 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.19856 153.3
[M+Na]+ 262.18050 155.3
[M+NH4]+ 257.22510 157.8
[M+K]+ 278.15444 150.8
[M-H]- 238.18400 146.9
[M+Na-2H]- 260.16595 145.5
[M]+ 239.19073 149.9
[M]- 239.19183 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.