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

12
Patents

286.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.17540 169.1
[M+Na]+ 309.15734 173.9
[M-H]- 285.16084 172.6
[M+NH4]+ 304.20194 185.1
[M+K]+ 325.13128 171.1
[M+H-H2O]+ 269.16538 162.1
[M+HCOO]- 331.16632 189.3
[M+CH3COO]- 345.18197 206.7
[M+Na-2H]- 307.14279 173.7
[M]+ 286.16757 168.8
[M]- 286.16867 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