CID 18066

Aminotetralin

Structural Information

Molecular Formula

C₁₀H₁₃N

SMILES

C1CC(C2=CC=CC=C2C1)N

InChI

InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7,11H2

InChIKey

JRZGPXSSNPTNMA-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 36
References: 6096
Patents: 147.1048 Da
Monoisotopic Mass: 1.6
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	129.1
[M+Na]+	170.09402	135.6
[M-H]-	146.09752	132.8
[M+NH4]+	165.13862	151.0
[M+K]+	186.06796	132.6
[M+H-H2O]+	130.10206	123.4
[M+HCOO]-	192.10300	150.8
[M+CH3COO]-	206.11865	142.3
[M+Na-2H]-	168.07947	136.7
[M]+	147.10425	123.9
[M]-	147.10535	123.9

Literature stripe

literature stripe

Patent stripe

patents stripe