CID 66523421

Tert-butyl n-[2-amino-2-(naphthalen-2-yl)ethyl]carbamate

Structural Information

Molecular Formula
C17H22N2O2
SMILES
CC(C)(C)OC(=O)NCC(C1=CC2=CC=CC=C2C=C1)N
InChI
InChI=1S/C17H22N2O2/c1-17(2,3)21-16(20)19-11-15(18)14-9-8-12-6-4-5-7-13(12)10-14/h4-10,15H,11,18H2,1-3H3,(H,19,20)
InChIKey
GPXKIJMETNRECD-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-amino-2-naphthalen-2-ylethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

286.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.175396 169.1
[M+Na]+ 309.157338 173.9
[M-H]- 285.160844 172.6
[M+NH4]+ 304.201943 185.1
[M+K]+ 325.131278 171.1
[M+H-H2O]+ 269.165380 162.1
[M+HCOO]- 331.166321 189.3
[M+CH3COO]- 345.181971 206.7
[M+Na-2H]- 307.142786 173.7
[M]+ 286.16757142 168.8
[M]- 286.16866858 168.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe