CID 58850838

118951-68-1

Structural Information

Molecular Formula

C₂₅H₁₇N

SMILES

C1=CC=C2C(=C1)C3=C(C24C5=CC=CC=C5C6=CC=CC=C46)C=C(C=C3)N

InChI

InChI=1S/C25H17N/c26-16-13-14-20-19-9-3-6-12-23(19)25(24(20)15-16)21-10-4-1-7-17(21)18-8-2-5-11-22(18)25/h1-15H,26H2

InChIKey

UCFDALUXSMNRHK-UHFFFAOYSA-N

Compound name

9,9'-spirobi[fluorene]-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 496
Patents: 331.1361 Da
Monoisotopic Mass: 5.7
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]+	332.14338	179.1
[M+Na]+	354.12532	190.7
[M-H]-	330.12882	189.3
[M+NH4]+	349.16992	202.3
[M+K]+	370.09926	181.1
[M+H-H2O]+	314.13336	170.8
[M+HCOO]-	376.13430	200.3
[M+CH3COO]-	390.14995	191.2
[M+Na-2H]-	352.11077	184.0
[M]+	331.13555	179.3
[M]-	331.13665	179.3

Literature stripe

literature stripe

Patent stripe

patents stripe