2-[1-(1,3-Benzodioxol-5-yl)propan-2-yl]-6-methoxy-4-prop-2-enylphenol, ac derivative

SpectraBase Compound ID	5gpNBBbl73F
InChI	InChI=1S/C22H24O5/c1-5-6-16-10-18(22(27-15(3)23)21(12-16)24-4)14(2)9-17-7-8-19-20(11-17)26-13-25-19/h5,7-8,10-12,14H,1,6,9,13H2,2-4H3
InChIKey	MRSWBVWLIAQJDF-UHFFFAOYSA-N Google Search
Mol Weight	368.43 g/mol
Molecular Formula	C22H24O5
Exact Mass	368.162374 g/mol

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SpectraBase Spectrum ID	32uhxFU4hhH
Name	2-[1-(1,3-Benzodioxol-5-yl)propan-2-yl]-6-methoxy-4-prop-2-enylphenol, ac derivative
Comments	Computed using SmartSpectra Model v1.42
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	368.162373868 u
Formula	C22H24O5
InChI	InChI=1S/C22H24O5/c1-5-6-16-10-18(22(27-15(3)23)21(12-16)24-4)14(2)9-17-7-8-19-20(11-17)26-13-25-19/h5,7-8,10-12,14H,1,6,9,13H2,2-4H3
InChIKey	MRSWBVWLIAQJDF-UHFFFAOYSA-N
Molecular Weight	368.429 g/mol
SMILES	C1(=C(C=C(C=C1OC)CC=C)C(CC1=CC=C2OCOC2=C1)C)OC(=O)C
Spectrum/Structure Validation Score (Vapor Phase IR)	0.875209