CID 43809420

1-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

CC1(CCCC2=CC=CC=C21)N

InChI

InChI=1S/C11H15N/c1-11(12)8-4-6-9-5-2-3-7-10(9)11/h2-3,5,7H,4,6,8,12H2,1H3

InChIKey

JUIZVGNNUOJFDZ-UHFFFAOYSA-N

Compound name

1-methyl-3,4-dihydro-2H-naphthalen-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 72
Patents: 161.12045 Da
Monoisotopic Mass: 1.8
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]+	162.12773	134.8
[M+Na]+	184.10967	147.6
[M+NH4]+	179.15427	146.9
[M+K]+	200.08361	138.0
[M-H]-	160.11317	139.3
[M+Na-2H]-	182.09512	143.5
[M]+	161.11990	138.1
[M]-	161.12100	138.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe