CID 20588031

246873-46-1

Structural Information

Molecular Formula
C15H22N2O2
SMILES
CC(C)(C)OC(=O)NC1CCCC2=C1C=C(C=C2)N
InChI
InChI=1S/C15H22N2O2/c1-15(2,3)19-14(18)17-13-6-4-5-10-7-8-11(16)9-12(10)13/h7-9,13H,4-6,16H2,1-3H3,(H,17,18)
InChIKey
LTLPUSMWZUFSTA-UHFFFAOYSA-N
Compound name
tert-butyl N-(7-amino-1,2,3,4-tetrahydronaphthalen-1-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

262.16812 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.175396 161.8
[M+Na]+ 285.157338 166.7
[M-H]- 261.160844 165.3
[M+NH4]+ 280.201943 179.0
[M+K]+ 301.131278 164.2
[M+H-H2O]+ 245.165380 155.5
[M+HCOO]- 307.166321 180.8
[M+CH3COO]- 321.181971 201.7
[M+Na-2H]- 283.142786 166.1
[M]+ 262.16757142 159.0
[M]- 262.16866858 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