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(S)-tert-butyl (1-benzylpiperidin-3-yl)carbamate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(S)-tert-butyl (1-benzylpiperidin-3-yl)carbamate
SpectraBase Compound ID 4w0qEopzaXx
InChI InChI=1S/C17H26N2O2/c1-17(2,3)21-16(20)18-15-10-7-11-19(13-15)12-14-8-5-4-6-9-14/h4-6,8-9,15H,7,10-13H2,1-3H3,(H,18,20)/t15-/m0/s1
InChIKey IJLXSEZUQISPRL-HNNXBMFYSA-N
Mol Weight 290.41 g/mol
Molecular Formula C17H26N2O2
Exact Mass 290.199428 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8Usfp5NHpGx
Name (S)-Tert-butyl (1-benzylpiperidin-3-yl)carbamate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.199428083 u
Formula C17H26N2O2
InChI InChI=1S/C17H26N2O2/c1-17(2,3)21-16(20)18-15-10-7-11-19(13-15)12-14-8-5-4-6-9-14/h4-6,8-9,15H,7,10-13H2,1-3H3,(H,18,20)/t15-/m0/s1
InChIKey IJLXSEZUQISPRL-HNNXBMFYSA-N
SMILES C1CC[C@@](CN1CC1=CC=CC=C1)(NC(=O)OC(C)(C)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931863