CID 136931

1194-56-5

Structural Information

Molecular Formula

C₁₀H₁₀

SMILES

C=C1CCC2=CC=CC=C12

InChI

InChI=1S/C10H10/c1-8-6-7-9-4-2-3-5-10(8)9/h2-5H,1,6-7H2

InChIKey

NCSZRNMVUILZEC-UHFFFAOYSA-N

Compound name

3-methylidene-1,2-dihydroindene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 810
Patents: 130.07825 Da
Monoisotopic Mass: 2.6
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]+	131.08553	124.8
[M+Na]+	153.06747	133.5
[M-H]-	129.07097	129.5
[M+NH4]+	148.11207	149.9
[M+K]+	169.04141	130.3
[M+H-H2O]+	113.07551	120.0
[M+HCOO]-	175.07645	148.5
[M+CH3COO]-	189.09210	139.7
[M+Na-2H]-	151.05292	131.6
[M]+	130.07770	122.8
[M]-	130.07880	122.8

Literature stripe

literature stripe

Patent stripe

patents stripe