CID 10192615

312753-70-1

Structural Information

Molecular Formula

C₁₃H₁₉N

SMILES

CCC1=C(C=C2CC(CC2=C1)N)CC

InChI

InChI=1S/C13H19N/c1-3-9-5-11-7-13(14)8-12(11)6-10(9)4-2/h5-6,13H,3-4,7-8,14H2,1-2H3

InChIKey

KGVIJLMNQNSQHB-UHFFFAOYSA-N

Compound name

5,6-diethyl-2,3-dihydro-1H-inden-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 288
Patents: 189.15175 Da
Monoisotopic Mass: 2.9
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]+	190.15903	143.3
[M+Na]+	212.14097	155.1
[M+NH4]+	207.18557	153.2
[M+K]+	228.11491	149.2
[M-H]-	188.14447	146.9
[M+Na-2H]-	210.12642	148.4
[M]+	189.15120	146.0
[M]-	189.15230	146.0

Literature stripe

literature stripe

Patent stripe

patents stripe