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S-tert-Butyl (S)-5-Oxo-3-phenylheptanethioate
SpectraBase Compound ID n315Z84kHd
InChI InChI=1S/C17H24O2S/c1-5-15(18)11-14(13-9-7-6-8-10-13)12-16(19)20-17(2,3)4/h6-10,14H,5,11-12H2,1-4H3/t14-/m0/s1
InChIKey XGFSHWXRJVEDEC-AWEZNQCLSA-N
Mol Weight 292.44 g/mol
Molecular Formula C17H24O2S
Exact Mass 292.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cOyaxY4p69
Name S-tert-Butyl (S)-5-Oxo-3-phenylheptanethioate
Alternate Name(s) S-(tert-butyl) (3S)-5-oxo-3-phenylheptanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O2S
InChI InChI=1S/C17H24O2S/c1-5-15(18)11-14(13-9-7-6-8-10-13)12-16(19)20-17(2,3)4/h6-10,14H,5,11-12H2,1-4H3/t14-/m0/s1
InChIKey XGFSHWXRJVEDEC-AWEZNQCLSA-N
Molecular Weight 292.437 g/mol
SMILES C(C[C@](CC(CC)=O)(c1ccccc1)[H])(=O)SC(C)(C)C
SPLASH splash10-0udi-0190000000-6b42c1503f7bd3869f4c
Source of Spectrum F-68-10056-7
Wiley ID 1574002