PubChemLite - (+)-diisopinocampheyl chloroborane (C20H34BCl)

Structural Information

Molecular Formula

C₂₀H₃₄BCl

SMILES

B(C1CC2CC(C1C)C2(C)C)(C3CC4CC(C3C)C4(C)C)Cl

InChI

InChI=1S/C20H34BCl/c1-11-15-7-13(19(15,3)4)9-17(11)21(22)18-10-14-8-16(12(18)2)20(14,5)6/h11-18H,7-10H2,1-6H3

InChIKey

PSEHHVRCDVOTID-UHFFFAOYSA-N

Compound name

chloro-bis(2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)borane

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	321.25148	181.1
[M+Na]+	343.23342	183.2
[M+NH4]+	338.27802	187.9
[M+K]+	359.20736	174.8
[M-H]-	319.23692	175.5
[M+Na-2H]-	341.21887	172.3
[M]+	320.24365	178.6
[M]-	320.24475	178.6

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

321.25148

181.1

[M+Na]+

343.23342

183.2

[M+NH4]+

338.27802

187.9

[M+K]+

359.20736

174.8

[M-H]-

319.23692

175.5

[M+Na-2H]-

341.21887

172.3

[M]+

320.24365

178.6

[M]-

320.24475

178.6

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

(+)-diisopinocampheyl chloroborane

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe