CID 10326

Indan

Structural Information

Molecular Formula

C₉H₁₀

SMILES

C1CC2=CC=CC=C2C1

InChI

InChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4-5H,3,6-7H2

InChIKey

PQNFLJBBNBOBRQ-UHFFFAOYSA-N

Compound name

2,3-dihydro-1H-indene

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 198
References: 84785
Patents: 118.07825 Da
Monoisotopic Mass: 3.2
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]+	119.08553	122.3
[M+Na]+	141.06747	135.4
[M+NH4]+	136.11207	133.6
[M+K]+	157.04141	129.3
[M-H]-	117.07097	125.9
[M+Na-2H]-	139.05292	129.9
[M]+	118.07770	125.3
[M]-	118.07880	125.3

Literature stripe

literature stripe

Patent stripe

patents stripe