CID 4413142

Chlorodicyclohexylborane

Structural Information

Molecular Formula
C12H22BCl
SMILES
B(C1CCCCC1)(C2CCCCC2)Cl
InChI
InChI=1S/C12H22BCl/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKey
PBBOKJIYEZCTEH-UHFFFAOYSA-N
Compound name
chloro(dicyclohexyl)borane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

442
Patents

212.15031 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.15759 151.1
[M+Na]+ 235.13953 152.4
[M-H]- 211.14303 155.1
[M+NH4]+ 230.18413 169.6
[M+K]+ 251.11347 148.7
[M+H-H2O]+ 195.14757 144.7
[M+HCOO]- 257.14851 161.5
[M+CH3COO]- 271.16416 185.4
[M+Na-2H]- 233.12498 151.8
[M]+ 212.14976 142.5
[M]- 212.15086 142.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe