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(+-)[(2S,3S)-3-(hydroxymethyl)oxiran-2-yl](phenyl)methanone
SpectraBase Compound ID 1oR8gK3MB7C
InChI InChI=1S/C10H10O3/c11-6-8-10(13-8)9(12)7-4-2-1-3-5-7/h1-5,8,10-11H,6H2/t8-,10-/m0/s1
InChIKey VQVFZYUNMUDVBV-WPRPVWTQSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HJ6LW4Teglv
Name (+-)[(2S,3S)-3-(hydroxymethyl)oxiran-2-yl](phenyl)methanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.062994179 u
Formula C10H10O3
InChI InChI=1S/C10H10O3/c11-6-8-10(13-8)9(12)7-4-2-1-3-5-7/h1-5,8,10-11H,6H2/t8-,10-/m0/s1
InChIKey VQVFZYUNMUDVBV-WPRPVWTQSA-N
Molecular Weight 178.187 g/mol
SMILES [C@]1(O[C@]1(CO)[H])(C(=O)C1=CC=CC=C1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966349