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(4S,6'R)-(1',4'-Dioxaspiro[4.5]decane-6'-carbonyl)-4-isopropyl-5,5-diphenyloxazolidin-2-thione
SpectraBase Compound ID Hc8DUZAXNi
InChI InChI=1S/C27H31NO4S/c1-19(2)23-27(20-11-5-3-6-12-20,21-13-7-4-8-14-21)32-25(33)28(23)24(29)22-15-9-10-16-26(22)30-17-18-31-26/h3-8,11-14,19,22-23H,9-10,15-18H2,1-2H3/t22-,23-/m0/s1
InChIKey PHQBEQXNTKTLHR-GOTSBHOMSA-N
Mol Weight 465.61 g/mol
Molecular Formula C27H31NO4S
Exact Mass 465.19738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnxjgZADmyI
Name (4S,6'R)-(1',4'-Dioxaspiro[4.5]decane-6'-carbonyl)-4-isopropyl-5,5-diphenyloxazolidin-2-thione
Alternate Name(s) ((S)-4-isopropyl-5,5-diphenyl-2-thioxooxazolidin-3-yl)((R)-1,4-dioxaspiro[4.5]decan-6-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H31NO4S
InChI InChI=1S/C27H31NO4S/c1-19(2)23-27(20-11-5-3-6-12-20,21-13-7-4-8-14-21)32-25(33)28(23)24(29)22-15-9-10-16-26(22)30-17-18-31-26/h3-8,11-14,19,22-23H,9-10,15-18H2,1-2H3/t22-,23-/m0/s1
InChIKey PHQBEQXNTKTLHR-GOTSBHOMSA-N
Literature Reference DOI 10.1016/j.tet.2015.02.083
Molecular Weight 465.608 g/mol
SMILES C12([C@@](CCCC2)(C(N2[C@](C(OC2=S)(c2ccccc2)c2ccccc2)(C(C)C)[H])=O)[H])OCCO1
SPLASH splash10-00di-1590000000-743d81ed00205f0f69c9
Source of Spectrum F-71-2216-23a
Wiley ID 1802930