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(2S)-5-Benzyloxy-2-methyl-1-pentanal

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

(2S)-5-Benzyloxy-2-methyl-1-pentanal
SpectraBase Compound ID 6cspASby0lX
InChI InChI=1S/C13H18O2/c1-12(10-14)6-5-9-15-11-13-7-3-2-4-8-13/h2-4,7-8,10,12H,5-6,9,11H2,1H3/t12-/m0/s1
InChIKey WMGLDZHURAJTMB-LBPRGKRZSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IfUEW9HnVq0
Name (2S)-5-Benzyloxy-2-methyl-1-pentanal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 206.130679818 u
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-12(10-14)6-5-9-15-11-13-7-3-2-4-8-13/h2-4,7-8,10,12H,5-6,9,11H2,1H3/t12-/m0/s1
InChIKey WMGLDZHURAJTMB-LBPRGKRZSA-N
Molecular Weight 206.285 g/mol
SMILES C(=O)[C@](CCCOCC=1C=CC=CC1)(C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.974051