CID 10131000

Ot-551

Structural Information

Molecular Formula

C₁₃H₂₃NO₃

SMILES

CC1(CC(CC(N1O)(C)C)OC(=O)C2CC2)C

InChI

InChI=1S/C13H23NO3/c1-12(2)7-10(8-13(3,4)14(12)16)17-11(15)9-5-6-9/h9-10,16H,5-8H2,1-4H3

InChIKey

ZWEXEKJLDHNLLA-UHFFFAOYSA-N

Compound name

(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) cyclopropanecarboxylate

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 3
References: 292
Patents: 241.1678 Da
Monoisotopic Mass: 1.9
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]+	242.175076	158.2
[M+Na]+	264.157018	166.6
[M-H]-	240.160524	163.1
[M+NH4]+	259.201623	173.3
[M+K]+	280.130958	165.5
[M+H-H2O]+	224.165060	153.8
[M+HCOO]-	286.166001	173.9
[M+CH3COO]-	300.181651	194.1
[M+Na-2H]-	262.142466	160.5
[M]+	241.16725142	160.4
[M]-	241.16834858	160.4

Literature stripe

literature stripe

Patent stripe

patents stripe