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(4S,5S)-4-(((benzyloxy)methoxy)methyl)-5-methyltetrahydropyran-2-one

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

(4S,5S)-4-(((benzyloxy)methoxy)methyl)-5-methyltetrahydropyran-2-one
SpectraBase Compound ID IFDUtBx5gMw
InChI InChI=1S/C15H20O4/c1-12-8-19-15(16)7-14(12)10-18-11-17-9-13-5-3-2-4-6-13/h2-6,12,14H,7-11H2,1H3/t12-,14-/m1/s1
InChIKey OAGCUFMLGBPLRS-TZMCWYRMSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HCiQvlbFDJV
Name (4S,5S)-4-(((benzyloxy)methoxy)methyl)-5-methyltetrahydropyran-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 264.136159120 u
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-12-8-19-15(16)7-14(12)10-18-11-17-9-13-5-3-2-4-6-13/h2-6,12,14H,7-11H2,1H3/t12-,14-/m1/s1
InChIKey OAGCUFMLGBPLRS-TZMCWYRMSA-N
Molecular Weight 264.321 g/mol
SMILES C1(OC[C@]([C@](C1)(COCOCC1=CC=CC=C1)[H])(C)[H])=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.985192