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(S)-4-(1-Acetoxyallyl)phenyl acetate

View entire compound with spectra: 1 FTIR

(S)-4-(1-Acetoxyallyl)phenyl acetate
SpectraBase Compound ID G8DBhtQWpDK
InChI InChI=1S/C13H14O4/c1-4-13(17-10(3)15)11-5-7-12(8-6-11)16-9(2)14/h4-8,13H,1H2,2-3H3/t13-/m0/s1
InChIKey JAMQIUWGGBSIKZ-ZDUSSCGKSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DBfrxfcmxpR
Name (S)-4-(1-Acetoxyallyl)phenyl acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.089208927 u
Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-4-13(17-10(3)15)11-5-7-12(8-6-11)16-9(2)14/h4-8,13H,1H2,2-3H3/t13-/m0/s1
InChIKey JAMQIUWGGBSIKZ-ZDUSSCGKSA-N
Molecular Weight 234.251 g/mol
SMILES C1(=CC=C(C=C1)OC(=O)C)[C@](C=C)(OC(=O)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.973196