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(Phenylmethyl) 2-oxidanylidenepiperidine-1-carboxylate

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

(Phenylmethyl) 2-oxidanylidenepiperidine-1-carboxylate
SpectraBase Compound ID KI4KCf5tpnZ
InChI InChI=1S/C13H15NO3/c15-12-8-4-5-9-14(12)13(16)17-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2
InChIKey LKGMGCSFOUSKCR-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Dm78sd4aF09
Name (Phenylmethyl) 2-oxidanylidenepiperidine-1-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 233.105193344 u
Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c15-12-8-4-5-9-14(12)13(16)17-10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2
InChIKey LKGMGCSFOUSKCR-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES C(N1C(=O)CCCC1)(OCC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.832354