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1,3-Dioxolan-4-one, 2-(1,1-dimethylethyl)-5-methyl-5-(1-methyl-2-nitroethyl)-, [2S-[2.alpha.,5.beta.(S*)]]-
SpectraBase Compound ID CHz4RnhGNRn
InChI InChI=1S/C11H19NO5/c1-7(6-12(14)15)11(5)8(13)16-9(17-11)10(2,3)4/h7,9H,6H2,1-5H3/t7-,9-,11-/m1/s1
InChIKey UASVRBVLCMYMKX-BCMRRPTOSA-N
Mol Weight 245.27 g/mol
Molecular Formula C11H19NO5
Exact Mass 245.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID OI29mIak6v
Name 1,3-Dioxolan-4-one, 2-(1,1-dimethylethyl)-5-methyl-5-(1-methyl-2-nitroethyl)-, [2S-[2.alpha.,5.beta.(S*)]]-
Alternate Name(s) (2S,5R)-2-tert-butyl-5-methyl-5-[(1R)-1-methyl-2-nitroethyl]-1,3-dioxolan-4-one (2S,5R,2'R)-2-(tert-butyl)-5-methyl-5-(1'-nitropropan-2'-yl)-1,3-dioxolan-4-on
CAS Registry Number 104194-01-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19NO5
InChI InChI=1S/C11H19NO5/c1-7(6-12(14)15)11(5)8(13)16-9(17-11)10(2,3)4/h7,9H,6H2,1-5H3/t7-,9-,11-/m1/s1
InChIKey UASVRBVLCMYMKX-BCMRRPTOSA-N
Molecular Weight 245.275 g/mol
SMILES [C@@]1(C(O[C@](O1)(C(C)(C)C)[H])=O)([C@@](CN(=O)=O)(C)[H])C
SPLASH splash10-052u-9100000000-cc114e14fa83c1f393b6
Source of Spectrum H-68-1599-3
Wiley ID 1247829