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6'-Ethylthio n-hexyl phenylglyoxylate

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6'-Ethylthio n-hexyl phenylglyoxylate
SpectraBase Compound ID 33RtgGVf2MD
InChI InChI=1S/C16H22O3S/c1-2-20-13-9-4-3-8-12-19-16(18)15(17)14-10-6-5-7-11-14/h5-7,10-11H,2-4,8-9,12-13H2,1H3
InChIKey DZWWIPOVFHHISW-UHFFFAOYSA-N
Mol Weight 294.41 g/mol
Molecular Formula C16H22O3S
Exact Mass 294.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KOelNoIk5lU
Name 6'-Ethylthio n-hexyl phenylglyoxylate
Alternate Name(s) 6-(ethylsulfanyl)hexyl oxo(phenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O3S
InChI InChI=1S/C16H22O3S/c1-2-20-13-9-4-3-8-12-19-16(18)15(17)14-10-6-5-7-11-14/h5-7,10-11H,2-4,8-9,12-13H2,1H3
InChIKey DZWWIPOVFHHISW-UHFFFAOYSA-N
Molecular Weight 294.409 g/mol
SMILES C(C(=O)OCCCCCCSCC)(=O)c1ccccc1
SPLASH splash10-0a4i-2900000000-4e4e3ed33b445f995209
Source of Spectrum F-53-7174-2
Wiley ID 802254