CID 11065582

139290-70-3

Structural Information

Molecular Formula

C₁₃H₂₄N₂O₄

SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)OC

InChI

InChI=1S/C13H24N2O4/c1-13(2,3)19-12(17)15-8-6-10(7-9-15)11(16)14(4)18-5/h10H,6-9H2,1-5H3

InChIKey

ITCQNWXLNZGEHP-UHFFFAOYSA-N

Compound name

tert-butyl 4-[methoxy(methyl)carbamoyl]piperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 880
Patents: 272.1736 Da
Monoisotopic Mass: 1.1
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]+	273.18088	163.6
[M+Na]+	295.16282	167.1
[M-H]-	271.16632	166.3
[M+NH4]+	290.20742	178.9
[M+K]+	311.13676	168.6
[M+H-H2O]+	255.17086	156.7
[M+HCOO]-	317.17180	180.6
[M+CH3COO]-	331.18745	202.6
[M+Na-2H]-	293.14827	164.6
[M]+	272.17305	164.5
[M]-	272.17415	164.5

Literature stripe

literature stripe

Patent stripe

patents stripe