CID 3043616

55875-57-5

Structural Information

Molecular Formula

C₁₃H₂₀N₂

SMILES

CC(CC1=CC2=C(C=C1)N(CCC2)C)N

InChI

InChI=1S/C13H20N2/c1-10(14)8-11-5-6-13-12(9-11)4-3-7-15(13)2/h5-6,9-10H,3-4,7-8,14H2,1-2H3

InChIKey

SHRNQTPSBJMGFI-UHFFFAOYSA-N

Compound name

1-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)propan-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 204.16264 Da
Monoisotopic Mass: 2.2
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	148.6
[M+Na]+	227.15186	154.4
[M-H]-	203.15536	150.6
[M+NH4]+	222.19646	167.1
[M+K]+	243.12580	151.1
[M+H-H2O]+	187.15990	141.5
[M+HCOO]-	249.16084	166.9
[M+CH3COO]-	263.17649	191.4
[M+Na-2H]-	225.13731	152.6
[M]+	204.16209	144.7
[M]-	204.16319	144.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe