CID 114400

1-indanpropylamine, n,3-dimethyl-1-phenyl-, hydrochloride

Structural Information

Molecular Formula

C₂₀H₂₅N

SMILES

CC1CC(C2=CC=CC=C12)(CCCNC)C3=CC=CC=C3

InChI

InChI=1S/C20H25N/c1-16-15-20(13-8-14-21-2,17-9-4-3-5-10-17)19-12-7-6-11-18(16)19/h3-7,9-12,16,21H,8,13-15H2,1-2H3

InChIKey

HVMBWPFYNPZXHH-UHFFFAOYSA-N

Compound name

N-methyl-3-(3-methyl-1-phenyl-2,3-dihydroinden-1-yl)propan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 279.1987 Da
Monoisotopic Mass: 4.8
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]+	280.205976	168.7
[M+Na]+	302.187918	175.2
[M-H]-	278.191424	175.9
[M+NH4]+	297.232523	189.3
[M+K]+	318.161858	169.3
[M+H-H2O]+	262.195960	161.2
[M+HCOO]-	324.196901	191.3
[M+CH3COO]-	338.212551	180.3
[M+Na-2H]-	300.173366	172.9
[M]+	279.19815142	168.3
[M]-	279.19924858	168.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe