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3'-[(3-benzyloxy-4-methoxy)phenyl]spiro[2,3-dihydro-4H-1-benzopyran-3,2'-oxiran]-4-one
SpectraBase Compound ID BZCC1ClK5VQ
InChI InChI=1S/C24H20O5/c1-26-20-12-11-17(13-21(20)27-14-16-7-3-2-4-8-16)23-24(29-23)15-28-19-10-6-5-9-18(19)22(24)25/h2-13,23H,14-15H2,1H3
InChIKey YIVPOYYHNQIXMJ-UHFFFAOYSA-N
Mol Weight 388.42 g/mol
Molecular Formula C24H20O5
Exact Mass 388.131074 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5WXlldUjb09
Name 3'-[(3-benzyloxy-4-methoxy)phenyl]spiro[2,3-dihydro-4H-1-benzopyran-3,2'-oxiran]-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.131073739 u
Formula C24H20O5
InChI InChI=1S/C24H20O5/c1-26-20-12-11-17(13-21(20)27-14-16-7-3-2-4-8-16)23-24(29-23)15-28-19-10-6-5-9-18(19)22(24)25/h2-13,23H,14-15H2,1H3
InChIKey YIVPOYYHNQIXMJ-UHFFFAOYSA-N
Molecular Weight 388.419 g/mol
SMILES C12(OC2C=2C=C(OCC=3C=CC=CC3)C(=CC2)OC)C(C2=CC=CC=C2OC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846145