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(2R,3S)-2-(2,2-Diphenylbenzo[1,3]dioxol-5-yl)-5,7-dimethoxychroman-3-ol
SpectraBase Compound ID sSr3vL4aY1
InChI InChI=1S/C30H26O6/c1-32-22-16-26(33-2)23-18-24(31)29(34-27(23)17-22)19-13-14-25-28(15-19)36-30(35-25,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-17,24,29,31H,18H2,1-2H3/t24-,29+/m0/s1
InChIKey SBFZGOWFNYBIFW-PWUYWRBVSA-N
Mol Weight 482.53 g/mol
Molecular Formula C30H26O6
Exact Mass 482.172939 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DiF2eTAH0i9
Name (2R,3S)-2-(2,2-Diphenylbenzo[1,3]dioxol-5-yl)-5,7-dimethoxychroman-3-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.172938551 u
Formula C30H26O6
InChI InChI=1S/C30H26O6/c1-32-22-16-26(33-2)23-18-24(31)29(34-27(23)17-22)19-13-14-25-28(15-19)36-30(35-25,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-17,24,29,31H,18H2,1-2H3/t24-,29+/m0/s1
InChIKey SBFZGOWFNYBIFW-PWUYWRBVSA-N
Molecular Weight 482.532 g/mol
SMILES [C@@]1([C@](CC=2C(=CC(=CC2O1)OC)OC)(O)[H])(C=1C=C2OC(OC2=CC1)(C=1C=CC=CC1)C=1C=CC=CC1)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.837524