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(4S)-4-[(1S)-1-Benzyloxy-2-hydroxyethyl)]-4-trifluoromethyloxazidine-2-one dimer
SpectraBase Compound ID 9stRI2RoIa6
InChI InChI=1S/2C13H14F3NO4/c2*14-13(15,16)12(8-21-11(19)17-12)10(6-18)20-7-9-4-2-1-3-5-9/h2*1-5,10,18H,6-8H2,(H,17,19)/t2*10-,12+/m11/s1
InChIKey OXRHHBHJGMEKBJ-NLSCXGDNSA-N
Mol Weight 610.51 g/mol
Molecular Formula C26H28F6N2O8
Exact Mass 610.174985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KsuudMEfEQ
Name (4S)-4-[(1S)-1-Benzyloxy-2-hydroxyethyl)]-4-trifluoromethyloxazidine-2-one dimer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28F6N2O8
InChI InChI=1S/2C13H14F3NO4/c2*14-13(15,16)12(8-21-11(19)17-12)10(6-18)20-7-9-4-2-1-3-5-9/h2*1-5,10,18H,6-8H2,(H,17,19)/t2*10-,12+/m11/s1
InChIKey OXRHHBHJGMEKBJ-NLSCXGDNSA-N
Molecular Weight 610.506 g/mol
SMILES N1C(OC[C@]1([C@@](CO)(OCc1ccccc1)[H])C(F)(F)F)=O.N1C(OC[C@]1([C@@](CO)(OCc1ccccc1)[H])C(F)(F)F)=O
SPLASH splash10-0006-9003001000-df169fe31aaffb7d8abc
Source of Spectrum J-64-8735-12
Wiley ID 1531575