CID 127856

152302-33-5

Structural Information

Molecular Formula

C₁₇H₁₉NO

SMILES

C1CC(C1)C(=O)NCCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H19NO/c19-17(15-8-4-9-15)18-12-11-14-7-3-6-13-5-1-2-10-16(13)14/h1-3,5-7,10,15H,4,8-9,11-12H2,(H,18,19)

InChIKey

GLXSBZGTGMPDKH-UHFFFAOYSA-N

Compound name

N-(2-naphthalen-1-ylethyl)cyclobutanecarboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 17
References: 19
Patents: 253.14667 Da
Monoisotopic Mass: 3.7
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]+	254.15395	158.7
[M+Na]+	276.13589	166.9
[M+NH4]+	271.18049	164.0
[M+K]+	292.10983	160.6
[M-H]-	252.13939	161.0
[M+Na-2H]-	274.12134	163.9
[M]+	253.14612	159.3
[M]-	253.14722	159.3

Literature stripe

literature stripe

Patent stripe

patents stripe