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[4,4-bis(Ethoxycarbonyl)-2-(2',2'-dimethylpropyl)cyclopentyl]methyl Phenyl Sulfide
SpectraBase Compound ID IUV3EA06rNV
InChI InChI=1S/C23H34O4S/c1-6-26-20(24)23(21(25)27-7-2)14-17(13-22(3,4)5)18(15-23)16-28-19-11-9-8-10-12-19/h8-12,17-18H,6-7,13-16H2,1-5H3
InChIKey UXHWIJCQADATHU-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C23H34O4S
Exact Mass 406.217781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DedRfqNVg4O
Name [4,4-bis(Ethoxycarbonyl)-2-(2',2'-dimethylpropyl)cyclopentyl]methyl Phenyl Sulfide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O4S
InChI InChI=1S/C23H34O4S/c1-6-26-20(24)23(21(25)27-7-2)14-17(13-22(3,4)5)18(15-23)16-28-19-11-9-8-10-12-19/h8-12,17-18H,6-7,13-16H2,1-5H3
InChIKey UXHWIJCQADATHU-UHFFFAOYSA-N
Molecular Weight 406.581 g/mol
SMILES C1(CC(CC(C)(C)C)C(C1)CSc1ccccc1)(C(=O)OCC)C(=O)OCC
SPLASH splash10-06di-6920200000-3881e488f9bc0d7fe135
Source of Spectrum C-118-9836-B
Wiley ID 1698852