CID 165995257

En300-26625350

Structural Information

Molecular Formula
C11H18BNO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2CC(C2)C#N
InChI
InChI=1S/C11H18BNO2/c1-10(2)11(3,4)15-12(14-10)9-5-8(6-9)7-13/h8-9H,5-6H2,1-4H3
InChIKey
KCHOZXJEDLTZLN-UHFFFAOYSA-N
Compound name
3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclobutane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.14307 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.150346 130.4
[M+Na]+ 230.132288 139.8
[M-H]- 206.135794 138.0
[M+NH4]+ 225.176893 145.2
[M+K]+ 246.106228 142.0
[M+H-H2O]+ 190.140330 117.3
[M+HCOO]- 252.141271 146.3
[M+CH3COO]- 266.156921 201.1
[M+Na-2H]- 228.117736 136.3
[M]+ 207.14252142 135.3
[M]- 207.14361858 135.3
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.