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3-Oxo-2,2-dimethyl-(4-chlorothiophenoxy)-8-octyl formate
SpectraBase Compound ID 9pjJ1F6bRsQ
InChI InChI=1S/C17H23ClO3S/c1-17(2,12-22-15-9-7-14(18)8-10-15)16(20)6-4-3-5-11-21-13-19/h7-10,13H,3-6,11-12H2,1-2H3
InChIKey MUHNCHDLGCSDTO-UHFFFAOYSA-N
Mol Weight 342.88 g/mol
Molecular Formula C17H23ClO3S
Exact Mass 342.105643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L3SM4matrqt
Name 3-Oxo-2,2-dimethyl-(4-chlorothiophenoxy)-8-octyl formate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23ClO3S
InChI InChI=1S/C17H23ClO3S/c1-17(2,12-22-15-9-7-14(18)8-10-15)16(20)6-4-3-5-11-21-13-19/h7-10,13H,3-6,11-12H2,1-2H3
InChIKey MUHNCHDLGCSDTO-UHFFFAOYSA-N
Molecular Weight 342.881 g/mol
SMILES C(C(=O)CCCCCOC=O)(CSc1ccc(cc1)Cl)(C)C
SPLASH splash10-0a4i-9201000000-d103f9a4c6a7a067e7ec
Source of Spectrum F-53-6606-137
Synonyms 8-[(4-chlorophenyl)sulfanyl]-7,7-dimethyl-6-oxooctyl formate
Wiley ID 802092