CID 2769591

179557-01-8

Structural Information

Molecular Formula

C₁₃H₂₄N₂O₂

SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC2CC2

InChI

InChI=1S/C13H24N2O2/c1-13(2,3)17-12(16)15-8-6-11(7-9-15)14-10-4-5-10/h10-11,14H,4-9H2,1-3H3

InChIKey

GERLYNRROAQLRS-UHFFFAOYSA-N

Compound name

tert-butyl 4-(cyclopropylamino)piperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 151
Patents: 240.18378 Da
Monoisotopic Mass: 1.8
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]+	241.191056	159.7
[M+Na]+	263.172998	165.1
[M-H]-	239.176504	164.9
[M+NH4]+	258.217603	171.1
[M+K]+	279.146938	162.7
[M+H-H2O]+	223.181040	152.5
[M+HCOO]-	285.181981	177.1
[M+CH3COO]-	299.197631	196.8
[M+Na-2H]-	261.158446	162.6
[M]+	240.18323142	159.2
[M]-	240.18432858	159.2

Literature stripe

literature stripe

Patent stripe

patents stripe