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2-Hydroxy-1-(3'-benzyloxyphenyl)propan-1-one

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

2-Hydroxy-1-(3'-benzyloxyphenyl)propan-1-one
SpectraBase Compound ID CIwRE4t11tq
InChI InChI=1S/C16H16O3/c1-12(17)16(18)14-8-5-9-15(10-14)19-11-13-6-3-2-4-7-13/h2-10,12,17H,11H2,1H3
InChIKey TYIDSHCGKLNWGW-UHFFFAOYSA-N
Mol Weight 256.3 g/mol
Molecular Formula C16H16O3
Exact Mass 256.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GX84uWuJHTx
Name 2-Hydroxy-1-(3'-benzyloxyphenyl)propan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 256.109944372 u
Formula C16H16O3
InChI InChI=1S/C16H16O3/c1-12(17)16(18)14-8-5-9-15(10-14)19-11-13-6-3-2-4-7-13/h2-10,12,17H,11H2,1H3
InChIKey TYIDSHCGKLNWGW-UHFFFAOYSA-N
Molecular Weight 256.301 g/mol
SMILES C(C=1C=C(OCC2=CC=CC=C2)C=CC1)(=O)C(O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.913715