CID 16770270

891642-99-2

Structural Information

Molecular Formula

C₁₃H₂₀N₂

SMILES

CC(C)(CN)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C13H20N2/c1-13(2,10-14)15-8-7-11-5-3-4-6-12(11)9-15/h3-6H,7-10,14H2,1-2H3

InChIKey

RUZNMAAWLDJWOC-UHFFFAOYSA-N

Compound name

2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 10
Patents: 204.16264 Da
Monoisotopic Mass: 1.5
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]+	205.16992	148.1
[M+Na]+	227.15186	159.7
[M+NH4]+	222.19646	157.3
[M+K]+	243.12580	152.8
[M-H]-	203.15536	150.9
[M+Na-2H]-	225.13731	154.1
[M]+	204.16209	150.6
[M]-	204.16319	150.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe