CID 177799389

(9h-fluoren-9-yl)methyl n-{[(1s,3s)-3-aminocyclobutyl]methyl}carbamate

Structural Information

Molecular Formula

C₂₀H₂₂N₂O₂

SMILES

C1C(CC1N)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C20H22N2O2/c21-14-9-13(10-14)11-22-20(23)24-12-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,13-14,19H,9-12,21H2,(H,22,23)

InChIKey

FALDLDJWVSLSFN-UHFFFAOYSA-N

Compound name

9H-fluoren-9-ylmethyl N-[(3-aminocyclobutyl)methyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 322.16812 Da
Monoisotopic Mass: 2.9
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]+	323.175396	174.5
[M+Na]+	345.157338	178.5
[M-H]-	321.160844	181.8
[M+NH4]+	340.201943	185.1
[M+K]+	361.131278	177.1
[M+H-H2O]+	305.165380	161.2
[M+HCOO]-	367.166321	194.6
[M+CH3COO]-	381.181971	215.7
[M+Na-2H]-	343.142786	176.5
[M]+	322.16757142	182.2
[M]-	322.16866858	182.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.