CID 16641216

877859-58-0

Structural Information

Molecular Formula

C₁₄H₂₆N₂O₂

SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CNC2CC2

InChI

InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-8-6-11(7-9-16)10-15-12-4-5-12/h11-12,15H,4-10H2,1-3H3

InChIKey

CZXMVDICWYFHTA-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 38
Patents: 254.19943 Da
Monoisotopic Mass: 2.0
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]+	255.206706	163.9
[M+Na]+	277.188648	168.8
[M-H]-	253.192154	168.8
[M+NH4]+	272.233253	174.7
[M+K]+	293.162588	166.2
[M+H-H2O]+	237.196690	156.5
[M+HCOO]-	299.197631	180.9
[M+CH3COO]-	313.213281	199.6
[M+Na-2H]-	275.174096	166.2
[M]+	254.19888142	163.6
[M]-	254.19997858	163.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe