CID 25244

17910-26-8

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CCC2=CC=CC=C2C(C1)N

InChI

InChI=1S/C11H15N/c12-11-8-4-2-6-9-5-1-3-7-10(9)11/h1,3,5,7,11H,2,4,6,8,12H2

InChIKey

UFBOKWPYNNXYIS-UHFFFAOYSA-N

Compound name

6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 110
Patents: 161.12045 Da
Monoisotopic Mass: 2.1
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	132.4
[M+Na]+	184.10967	142.8
[M+NH4]+	179.15427	141.9
[M+K]+	200.08361	137.2
[M-H]-	160.11317	136.2
[M+Na-2H]-	182.09512	139.3
[M]+	161.11990	135.0
[M]-	161.12100	135.0

Literature stripe

literature stripe

Patent stripe

patents stripe