CID 16774798

2084-72-2

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

CNC1CCC2=CC=CC=C12

InChI

InChI=1S/C10H13N/c1-11-10-7-6-8-4-2-3-5-9(8)10/h2-5,10-11H,6-7H2,1H3

InChIKey

AIXUYZODYPPNAV-UHFFFAOYSA-N

Compound name

N-methyl-2,3-dihydro-1H-inden-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 293
Patents: 147.1048 Da
Monoisotopic Mass: 1.7
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]+	148.11208	129.5
[M+Na]+	170.09402	137.0
[M-H]-	146.09752	134.0
[M+NH4]+	165.13862	153.6
[M+K]+	186.06796	134.3
[M+H-H2O]+	130.10206	124.1
[M+HCOO]-	192.10300	154.1
[M+CH3COO]-	206.11865	178.0
[M+Na-2H]-	168.07947	136.7
[M]+	147.10425	127.5
[M]-	147.10535	127.5

Literature stripe

literature stripe

Patent stripe

patents stripe