CID 68018887

1161009-88-6

Structural Information

Molecular Formula

C₂₅H₁₅Br

SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C24C5=C(C6=CC=CC=C46)C(=CC=C5)Br

InChI

InChI=1S/C25H15Br/c26-23-15-7-14-22-24(23)18-10-3-6-13-21(18)25(22)19-11-4-1-8-16(19)17-9-2-5-12-20(17)25/h1-15H

InChIKey

GQXFSXMUBDPXBG-UHFFFAOYSA-N

Compound name

4-bromo-9,9'-spirobi[fluorene]

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 516
Patents: 394.0357 Da
Monoisotopic Mass: 7.1
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]+	395.04298	198.3
[M+Na]+	417.02492	212.5
[M-H]-	393.02842	210.9
[M+NH4]+	412.06952	222.7
[M+K]+	432.99886	198.2
[M+H-H2O]+	377.03296	197.3
[M+HCOO]-	439.03390	216.7
[M+CH3COO]-	453.04955	211.5
[M+Na-2H]-	415.01037	202.6
[M]+	394.03515	217.6
[M]-	394.03625	217.6

Literature stripe

literature stripe

Patent stripe

patents stripe