CID 9795269

67966-25-0

Structural Information

Molecular Formula

C₁₅H₃₃B

SMILES

[B-](C(C)C(C)C)(C(C)C(C)C)C(C)C(C)C

InChI

InChI=1S/C15H33B/c1-10(2)13(7)16(14(8)11(3)4)15(9)12(5)6/h10-15H,1-9H3/q-1

InChIKey

GNWBKOSXFRRWOJ-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 224.26753 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

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]+	225.274806	161.1
[M+Na]+	247.256748	162.8
[M-H]-	223.260254	158.6
[M+NH4]+	242.301353	178.9
[M+K]+	263.230688	163.3
[M+H-H2O]+	207.264790	158.6
[M+HCOO]-	269.265731	174.3
[M+CH3COO]-	283.281381	200.0
[M+Na-2H]-	245.242196	153.5
[M]+	224.26698142	159.4
[M]-	224.26807858	159.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe