CID 21618938

(2,3-dihydro-1h-inden-4-yl)methanamine

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

C1CC2=C(C1)C(=CC=C2)CN

InChI

InChI=1S/C10H13N/c11-7-9-5-1-3-8-4-2-6-10(8)9/h1,3,5H,2,4,6-7,11H2

InChIKey

KHEAFXLBELPDBH-UHFFFAOYSA-N

Compound name

2,3-dihydro-1H-inden-4-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 147.1048 Da
Monoisotopic Mass: 1.6
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]+	148.11208	130.0
[M+Na]+	170.09402	137.5
[M-H]-	146.09752	134.0
[M+NH4]+	165.13862	153.9
[M+K]+	186.06796	134.5
[M+H-H2O]+	130.10206	124.7
[M+HCOO]-	192.10300	154.0
[M+CH3COO]-	206.11865	177.3
[M+Na-2H]-	168.07947	136.1
[M]+	147.10425	127.1
[M]-	147.10535	127.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe