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(1S*,2R*,3R*,7aS*)-3-Acetyl-3-methyl-2-nitro-1-phenylazabicyclo[3.3.0]octane
SpectraBase Compound ID 8tU7VZpaKwv
InChI InChI=1S/C16H20N2O3/c1-11(19)16(2)15(18(20)21)14(12-7-4-3-5-8-12)13-9-6-10-17(13)16/h3-5,7-8,13-15H,6,9-10H2,1-2H3/t13-,14-,15+,16-/m0/s1
InChIKey YUAQNZBDLTUQFM-JONQDZQNSA-N
Mol Weight 288.35 g/mol
Molecular Formula C16H20N2O3
Exact Mass 288.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aeqg4Pdo4Tk
Name (1S*,2R*,3R*,7aS*)-3-Acetyl-3-methyl-2-nitro-1-phenylazabicyclo[3.3.0]octane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O3
InChI InChI=1S/C16H20N2O3/c1-11(19)16(2)15(18(20)21)14(12-7-4-3-5-8-12)13-9-6-10-17(13)16/h3-5,7-8,13-15H,6,9-10H2,1-2H3/t13-,14-,15+,16-/m0/s1
InChIKey YUAQNZBDLTUQFM-JONQDZQNSA-N
Molecular Weight 288.347 g/mol
SMILES [C@]1([C@@]([C@@](c2ccccc2)([C@]2(N1CCC2)[H])[H])(N(=O)=O)[H])(C(=O)C)C
SPLASH splash10-0002-0920000000-aa9354e7ca3730d61ec7
Source of Spectrum Y-47-667-4a
Synonyms 1-((1S,2R,3R,7aS)-3-Methyl-2-nitro-1-phenyl-hexahydro-pyrrolizin-3-yl)-ethanone 1-[(1S,2R,3R,8S)-3-methyl-2-nitro-1-phenyl-1,2,5,6,7,8-hexahydropyrrolizin-3-yl]ethanone
Wiley ID 1667201