CID 17846640

120278-07-1

Structural Information

Molecular Formula

C₁₃H₁₈N₂O₂

SMILES

C1CN(CCC1N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H18N2O2/c14-12-6-8-15(9-7-12)13(16)17-10-11-4-2-1-3-5-11/h1-5,12H,6-10,14H2

InChIKey

YYIQGSYCCNQAGV-UHFFFAOYSA-N

Compound name

benzyl 4-aminopiperidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 551
Patents: 234.13683 Da
Monoisotopic Mass: 1.2
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]+	235.14411	154.8
[M+Na]+	257.12605	165.6
[M+NH4]+	252.17065	162.4
[M+K]+	273.09999	159.4
[M-H]-	233.12955	158.2
[M+Na-2H]-	255.11150	161.2
[M]+	234.13628	157.0
[M]-	234.13738	157.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe