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(3S,4R)-3-Methoxy-5-nitro-4-phenylpentan-2-one
SpectraBase Compound ID 2IZDKzrOa3R
InChI InChI=1S/C12H15NO4/c1-9(14)12(17-2)11(8-13(15)16)10-6-4-3-5-7-10/h3-7,11-12H,8H2,1-2H3/t11-,12+/m0/s1
InChIKey PNXVVAXVUQBBCW-NWDGAFQWSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DjZVzuOUHU
Name (3S,4R)-3-Methoxy-5-nitro-4-phenylpentan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-9(14)12(17-2)11(8-13(15)16)10-6-4-3-5-7-10/h3-7,11-12H,8H2,1-2H3/t11-,12+/m0/s1
InChIKey PNXVVAXVUQBBCW-NWDGAFQWSA-N
Literature Reference DOI 10.1002/adsc.200404037
Molecular Weight 237.255 g/mol
SMILES CC([C@]([C@@](C[N+](=O)[O-])(c1ccccc1)[H])(OC)[H])=O
SPLASH splash10-0002-1900000000-806bc7f5299e78805c93
Source of Spectrum ASC-346-1161-6g+6g'
Wiley ID 1767666