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Methanone, [3-(3-chloro-3-methylbutyl)-2-hydroxy-4,6-dimethoxyphenyl](3,4-dihydr o-8-methoxy-2,2-dimethyl-2H-1-benzopyran-5-yl)-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Methanone, [3-(3-chloro-3-methylbutyl)-2-hydroxy-4,6-dimethoxyphenyl](3,4-dihydr o-8-methoxy-2,2-dimethyl-2H-1-benzopyran-5-yl)-
SpectraBase Compound ID 292Y1sNHHST
InChI InChI=1S/C26H33ClO6/c1-25(2,27)12-10-17-19(31-6)14-20(32-7)21(23(17)29)22(28)15-8-9-18(30-5)24-16(15)11-13-26(3,4)33-24/h8-9,14,29H,10-13H2,1-7H3
InChIKey ZONKGOKOEPNFRX-UHFFFAOYSA-N
Mol Weight 477.0 g/mol
Molecular Formula C26H33ClO6
Exact Mass 476.196566 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ha6Z14DlRcF
Name Methanone, [3-(3-chloro-3-methylbutyl)-2-hydroxy-4,6-dimethoxyphenyl](3,4-dihydr o-8-methoxy-2,2-dimethyl-2H-1-benzopyran-5-yl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 476.196566477 u
Formula C26H33ClO6
InChI InChI=1S/C26H33ClO6/c1-25(2,27)12-10-17-19(31-6)14-20(32-7)21(23(17)29)22(28)15-8-9-18(30-5)24-16(15)11-13-26(3,4)33-24/h8-9,14,29H,10-13H2,1-7H3
InChIKey ZONKGOKOEPNFRX-UHFFFAOYSA-N
Molecular Weight 476.997 g/mol
SMILES C=1(C(C2=C3C(OC(CC3)(C)C)=C(C=C2)OC)=O)C(=C(CCC(Cl)(C)C)C(=CC1OC)OC)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.96868