CID 22278845

866538-96-7

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₂

SMILES

CC1CNCCC1NC(=O)OC(C)(C)C

InChI

InChI=1S/C11H22N2O2/c1-8-7-12-6-5-9(8)13-10(14)15-11(2,3)4/h8-9,12H,5-7H2,1-4H3,(H,13,14)

InChIKey

LHSNRJGZDUFKQT-UHFFFAOYSA-N

Compound name

tert-butyl N-(3-methylpiperidin-4-yl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 50
Patents: 214.16812 Da
Monoisotopic Mass: 1.5
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]+	215.17540	151.7
[M+Na]+	237.15734	159.3
[M+NH4]+	232.20194	158.0
[M+K]+	253.13128	155.5
[M-H]-	213.16084	151.2
[M+Na-2H]-	235.14279	154.2
[M]+	214.16757	152.2
[M]-	214.16867	152.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe