CID 101236

6,6-diphenylfulvene

Structural Information

Molecular Formula

C₁₈H₁₄

SMILES

C1=CC=C(C=C1)C(=C2C=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H14/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16/h1-14H

InChIKey

BULLHRADHZGONG-UHFFFAOYSA-N

Compound name

[cyclopenta-2,4-dien-1-ylidene(phenyl)methyl]benzene

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 4
References: 663
Patents: 230.10954 Da
Monoisotopic Mass: 5.4
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]+	231.11682	155.3
[M+Na]+	253.09876	171.2
[M+NH4]+	248.14336	165.9
[M+K]+	269.07270	162.9
[M-H]-	229.10226	162.8
[M+Na-2H]-	251.08421	167.8
[M]+	230.10899	160.0
[M]-	230.11009	160.0

Literature stripe

literature stripe

Patent stripe

patents stripe