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(2R,5R,6S)-2-Tert-butyl-5-(Isopropylidenehydrazino)-6-trifluoromethyl-1,3-dioxan-4-one hydrochloride
SpectraBase Compound ID FA0hyEqEp1c
InChI InChI=1S/C12H19F3N2O3.ClH/c1-6(2)16-17-7-8(12(13,14)15)19-10(11(3,4)5)20-9(7)18;/h7-8,10,17H,1-5H3;1H/t7-,8+,10-;/m1./s1
InChIKey QZYPPJPSPHMLBL-JUHCGIOYSA-N
Mol Weight 332.75 g/mol
Molecular Formula C12H20ClF3N2O3
Exact Mass 332.111455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID amAFj4w1J8
Name (2R,5R,6S)-2-Tert-butyl-5-(Isopropylidenehydrazino)-6-trifluoromethyl-1,3-dioxan-4-one hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20ClF3N2O3
InChI InChI=1S/C12H19F3N2O3.ClH/c1-6(2)16-17-7-8(12(13,14)15)19-10(11(3,4)5)20-9(7)18;/h7-8,10,17H,1-5H3;1H/t7-,8+,10-;/m1./s1
InChIKey QZYPPJPSPHMLBL-JUHCGIOYSA-N
Molecular Weight 332.751 g/mol
SMILES [Cl-].[NH2+]([C@@]1([C@](O[C@](OC1=O)(C(C)(C)C)[H])(C(F)(F)F)[H])[H])N=C(C)C
SPLASH splash10-0002-2190000000-931234c8ef8382c5188b
Source of Spectrum F-52-289-23
Synonyms (2R,5R,6S)-5-(Isopropylidenehydrazino)-6-trifluoromethyl-1,3-dioxan-4-one hydrochloride 1-[(2R,5R,6S)-2-tert-butyl-4-oxo-6-(trifluoromethyl)-1,3-dioxan-5-yl]-2-(1-methylethylidene)hydrazinium chloride
Wiley ID 794582