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2-tert-Butyl-5-phenyl-5-(2-nitro-1-phenylethyl)-1,3-dioxolan-4-one
SpectraBase Compound ID DBrp6g2aYHK
InChI InChI=1S/C21H23NO5/c1-20(2,3)19-26-18(23)21(27-19,16-12-8-5-9-13-16)17(14-22(24)25)15-10-6-4-7-11-15/h4-13,17,19H,14H2,1-3H3
InChIKey XNSVGTGMEAYYOJ-UHFFFAOYSA-N
Mol Weight 369.42 g/mol
Molecular Formula C21H23NO5
Exact Mass 369.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPX9qCuGIGu
Name 2-tert-Butyl-5-phenyl-5-(2-nitro-1-phenylethyl)-1,3-dioxolan-4-one
Alternate Name(s) 2-tert-Butyl-5-(2-nitro-1-phenylethyl)-5-phenyl-1,3-dioxolan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO5
InChI InChI=1S/C21H23NO5/c1-20(2,3)19-26-18(23)21(27-19,16-12-8-5-9-13-16)17(14-22(24)25)15-10-6-4-7-11-15/h4-13,17,19H,14H2,1-3H3
InChIKey XNSVGTGMEAYYOJ-UHFFFAOYSA-N
Molecular Weight 369.417 g/mol
SMILES C1(OC(C(O1)=O)(C(CN(=O)=O)c1ccccc1)c1ccccc1)C(C)(C)C
SPLASH splash10-0a4i-0920000000-420d39e77b4a137818c7
Source of Spectrum KC-60-167-3
Wiley ID 1582867