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1-Hydroxymethyl-1-[2,2-(ethylenedioxy)propyl]-2-(2-methoxy-5-methylphenyl)-2-methyl-cyclopentane
SpectraBase Compound ID CADqPY4tWIL
InChI InChI=1S/C20H30O4/c1-15-6-7-17(22-4)16(12-15)18(2)8-5-9-20(18,14-21)13-19(3)23-10-11-24-19/h6-7,12,21H,5,8-11,13-14H2,1-4H3
InChIKey GZOJKBCNNCZOCJ-UHFFFAOYSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EbcfBCMELOq
Name 1-Hydroxymethyl-1-[2,2-(ethylenedioxy)propyl]-2-(2-methoxy-5-methylphenyl)-2-methyl-cyclopentane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.214409442 u
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-15-6-7-17(22-4)16(12-15)18(2)8-5-9-20(18,14-21)13-19(3)23-10-11-24-19/h6-7,12,21H,5,8-11,13-14H2,1-4H3
InChIKey GZOJKBCNNCZOCJ-UHFFFAOYSA-N
Molecular Weight 334.456 g/mol
SMILES C1(C(CCC1)(C)C=1C(=CC=C(C1)C)OC)(CC1(C)OCCO1)CO
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956862