CID 2724022

Potassium cyanoborodeuteride

Structural Information

Molecular Formula
CH3BN
SMILES
[2H][B-]([2H])([2H])C#N
InChI
InChI=1S/CH3BN/c2-1-3/h2H3/q-1/i2D3
InChIKey
IUDSCMPRPHGDII-BMSJAHLVSA-N
Compound name
cyano(trideuterio)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

43.054684 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 44.061960 108.4
[M+Na]+ 66.043902 117.8
[M-H]- 42.047408 108.0
[M+NH4]+ 61.088507 130.7
[M+K]+ 82.017842 118.5
[M+H-H2O]+ 26.051944 100.0
[M+HCOO]- 88.052885 128.5
[M+CH3COO]- 102.06854 169.1
[M+Na-2H]- 64.029350 117.4
[M]+ 43.054135 101.6
[M]- 43.055233 101.6
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

patents stripe