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S-(1-Benzoyl-3-oxo-3-phenylpropyl) 4-methylbenzenecarbothioate
SpectraBase Compound ID EpjMnw41AAs
InChI InChI=1S/C24H20O3S/c1-17-12-14-20(15-13-17)24(27)28-22(23(26)19-10-6-3-7-11-19)16-21(25)18-8-4-2-5-9-18/h2-15,22H,16H2,1H3
InChIKey RXPKGTVNEXTNQY-UHFFFAOYSA-N
Mol Weight 388.48 g/mol
Molecular Formula C24H20O3S
Exact Mass 388.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6RJheetngD1
Name S-(1-Benzoyl-3-oxo-3-phenylpropyl) 4-methylbenzenecarbothioate
Appearance Colorless powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20O3S
InChI InChI=1S/C24H20O3S/c1-17-12-14-20(15-13-17)24(27)28-22(23(26)19-10-6-3-7-11-19)16-21(25)18-8-4-2-5-9-18/h2-15,22H,16H2,1H3
InChIKey RXPKGTVNEXTNQY-UHFFFAOYSA-N
Instrument Name Finnigan Mat 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.d06
Molecular Weight 388.481 g/mol
SMILES c1(ccccc1)C(=O)C(CC(c1ccccc1)=O)SC(=O)c1ccc(cc1)C
SPLASH splash10-052r-3594000000-e84eb3210c0fefa4910c
Source of Spectrum ARK-2009-74-14b
Wiley ID 1869875