CID 75481286

Tert-butyl n-(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)carbamate

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CC(C)(C)OC(=O)NC1=CC2=C(C=C1)C(CCC2)N
InChI
InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-11-7-8-12-10(9-11)5-4-6-13(12)16/h7-9,13H,4-6,16H2,1-3H3,(H,17,18)
InChIKey
XBRUNVZVLNSKHL-UHFFFAOYSA-N
Compound name
tert-butyl N-(5-amino-5,6,7,8-tetrahydronaphthalen-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

262.16812 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.17540 161.8
[M+Na]+ 285.15734 166.7
[M-H]- 261.16084 165.3
[M+NH4]+ 280.20194 179.0
[M+K]+ 301.13128 164.2
[M+H-H2O]+ 245.16538 155.5
[M+HCOO]- 307.16632 180.8
[M+CH3COO]- 321.18197 201.7
[M+Na-2H]- 283.14279 166.1
[M]+ 262.16757 159.0
[M]- 262.16867 159.0
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