CID 36133

Brn 2467575

Structural Information

Molecular Formula

C₁₇H₂₆N₂O

SMILES

CCN(CC)CCNC(=O)C1CCCC2=CC=CC=C12

InChI

InChI=1S/C17H26N2O/c1-3-19(4-2)13-12-18-17(20)16-11-7-9-14-8-5-6-10-15(14)16/h5-6,8,10,16H,3-4,7,9,11-13H2,1-2H3,(H,18,20)

InChIKey

IAZRYSOMPVFZNF-UHFFFAOYSA-N

Compound name

N-[2-(diethylamino)ethyl]-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 274.2045 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]+	275.211776	167.4
[M+Na]+	297.193718	170.0
[M-H]-	273.197224	171.6
[M+NH4]+	292.238323	184.4
[M+K]+	313.167658	167.5
[M+H-H2O]+	257.201760	159.5
[M+HCOO]-	319.202701	188.1
[M+CH3COO]-	333.218351	209.3
[M+Na-2H]-	295.179166	170.5
[M]+	274.20395142	166.1
[M]-	274.20504858	166.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe