CID 50986497

Tert-butyl n-[(2-aminocyclopentyl)methyl]carbamate

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₂

SMILES

CC(C)(C)OC(=O)NCC1CCCC1N

InChI

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

InChIKey

GTBJUDHXQLLKID-UHFFFAOYSA-N

Compound name

tert-butyl N-[(2-aminocyclopentyl)methyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 214.16812 Da
Monoisotopic Mass: 1.7
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]+	215.175396	152.3
[M+Na]+	237.157338	156.4
[M-H]-	213.160844	154.8
[M+NH4]+	232.201943	172.1
[M+K]+	253.131278	155.6
[M+H-H2O]+	197.165380	146.6
[M+HCOO]-	259.166321	173.5
[M+CH3COO]-	273.181971	190.9
[M+Na-2H]-	235.142786	153.9
[M]+	214.16757142	149.3
[M]-	214.16866858	149.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe