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Ethyl 2-(Benzylthio)-2-[(o-methoxycarbonylmethyl)phenyl]acetate
SpectraBase Compound ID KYzjZ8erwQ7
InChI InChI=1S/C20H22O4S/c1-3-24-20(22)19(25-14-15-9-5-4-6-10-15)17-12-8-7-11-16(17)13-18(21)23-2/h4-12,19H,3,13-14H2,1-2H3
InChIKey IAQGEZBENAYJBT-UHFFFAOYSA-N
Mol Weight 358.45 g/mol
Molecular Formula C20H22O4S
Exact Mass 358.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8cFL8sUaqmq
Name Ethyl 2-(Benzylthio)-2-[(o-methoxycarbonylmethyl)phenyl]acetate
Alternate Name(s) Ethyl 2-(benzylthio)-2-(2-(2-methoxy-2-oxoethyl)phenyl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O4S
InChI InChI=1S/C20H22O4S/c1-3-24-20(22)19(25-14-15-9-5-4-6-10-15)17-12-8-7-11-16(17)13-18(21)23-2/h4-12,19H,3,13-14H2,1-2H3
InChIKey IAQGEZBENAYJBT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol703058p
Molecular Weight 358.452 g/mol
SMILES c1cc(CC(OC)=O)c(cc1)C(SCc1ccccc1)C(OCC)=O
SPLASH splash10-000f-9921000000-20da4e301d8a804fd630
Source of Spectrum A1-10-693/SMS1-3a
Wiley ID 1759145