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3-(1-Naphthyl)-3',4',5'-trimethoxy-trans-acrylophenone
SpectraBase Compound ID 39oLcauPEZ2
InChI InChI=1S/C22H20O4/c1-24-20-13-17(14-21(25-2)22(20)26-3)19(23)12-11-16-9-6-8-15-7-4-5-10-18(15)16/h4-14H,1-3H3/b12-11+
InChIKey NMLJBLROLYDCEP-VAWYXSNFSA-N
Mol Weight 348.4 g/mol
Molecular Formula C22H20O4
Exact Mass 348.136159 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 41eSbToj4KK
Name 3-(1-Naphthyl)-3',4',5'-trimethoxy-trans-acrylophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.136159120 u
Formula C22H20O4
InChI InChI=1S/C22H20O4/c1-24-20-13-17(14-21(25-2)22(20)26-3)19(23)12-11-16-9-6-8-15-7-4-5-10-18(15)16/h4-14H,1-3H3/b12-11+
InChIKey NMLJBLROLYDCEP-VAWYXSNFSA-N
Molecular Weight 348.398 g/mol
SMILES C=1C(=C(C(=CC1C(=O)\C=C\C1=CC=CC2=C1C=CC=C2)OC)OC)OC
Spectrum/Structure Validation Score (Raman) 0.964724