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(2' R,4S)-N-[2-(9'-Thiaxanthenyl)acetoacetyl]-4-benzyloxazolidin-22-one
SpectraBase Compound ID 5jGrT7ac1mX
InChI InChI=1S/C27H23NO4S/c1-17(29)24(25-20-11-5-7-13-22(20)33-23-14-8-6-12-21(23)25)26(30)28-19(16-32-27(28)31)15-18-9-3-2-4-10-18/h2-14,19,24-25H,15-16H2,1H3/t19-,24-/m0/s1
InChIKey GIVPGGQKMVSMQV-CYFREDJKSA-N
Mol Weight 457.54 g/mol
Molecular Formula C27H23NO4S
Exact Mass 457.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FM2YVvor7KV
Name (2' R,4S)-N-[2-(9'-Thiaxanthenyl)acetoacetyl]-4-benzyloxazolidin-22-one
Comments Less than 3 mono-isotopic peaks
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Formula C27H23NO4S
InChI InChI=1S/C27H23NO4S/c1-17(29)24(25-20-11-5-7-13-22(20)33-23-14-8-6-12-21(23)25)26(30)28-19(16-32-27(28)31)15-18-9-3-2-4-10-18/h2-14,19,24-25H,15-16H2,1H3/t19-,24-/m0/s1
InChIKey GIVPGGQKMVSMQV-CYFREDJKSA-N
Molecular Weight 457.544 g/mol
SMILES C(N1C(OC[C@@]1(Cc1ccccc1)[H])=O)([C@](C1c2c(Sc3c1cccc3)cccc2)(C(=O)C)[H])=O
SPLASH splash10-0002-0900000000-8c6fc665692a7adc21fe
Source of Spectrum Y-37-903-0
Synonyms (2R)-1-[(4S)-2-oxo-4-(phenylmethyl)-3-oxazolidinyl]-2-(9H-thioxanthen-9-yl)butane-1,3-dione (2R)-1-[(4S)-4-benzyl-2-oxo-1,3-oxazolidin-3-yl]-2-(9H-thioxanthen-9-yl)butane-1,3-dione (2R)-1-[(4S)-4-benzyl-2-oxo-oxazolidin-3-yl]-2-(9H-thioxanthen-9-yl)butane-1,3-dione (2R)-1-[(4S)-2-oxidanylidene-4-(phenylmethyl)-1,3-oxazolidin-3-yl]-2-(9H-thioxanthen-9-yl)butane-1,3-dione
Wiley ID 762834