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5aH-1,3-Dioxolo[3,4]furo[2,3-b]benzofuran, 3a,4-dihydro-8-methoxy-2,2-dimethyl-10-(phenylmethoxy)-, (3a.alpha.,5a.beta.,10bS*)-(.+-.)-
SpectraBase Compound ID 7GllH1tFzrx
InChI InChI=1S/C21H22O6/c1-20(2)26-17-12-24-19-21(17,27-20)18-15(9-14(22-3)10-16(18)25-19)23-11-13-7-5-4-6-8-13/h4-10,17,19H,11-12H2,1-3H3
InChIKey GYHHBLPWRMPAEZ-UHFFFAOYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 323w14J2pFY
Name 5ah-1,3-Dioxolo[3,4]furo[2,3-B]benzofuran, 3A,4-dihydro-8-methoxy-2,2-dimethyl-10-(phenylmethoxy)-, (3A.alpha.,5A.beta.,10BS*)-(.+-.)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.141638422 u
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-20(2)26-17-12-24-19-21(17,27-20)18-15(9-14(22-3)10-16(18)25-19)23-11-13-7-5-4-6-8-13/h4-10,17,19H,11-12H2,1-3H3
InChIKey GYHHBLPWRMPAEZ-UHFFFAOYSA-N
Molecular Weight 370.401 g/mol
SMILES C123C=4C(=CC(=CC4OCC4=CC=CC=C4)OC)OC2OCC3OC(O1)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.845751