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(3R,4R)-4-Nitropent-1-en-3-yl benzene
SpectraBase Compound ID 3OixS3GBGNg
InChI InChI=1S/C11H13NO2/c1-3-11(9(2)12(13)14)10-7-5-4-6-8-10/h3-9,11H,1H2,2H3/t9-,11+/m1/s1
InChIKey PXRCVUOBOXKQDO-KOLCDFICSA-N
Mol Weight 191.23 g/mol
Molecular Formula C11H13NO2
Exact Mass 191.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvBGXBriJzS
Name (3R,4R)-4-Nitropent-1-en-3-yl benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO2
InChI InChI=1S/C11H13NO2/c1-3-11(9(2)12(13)14)10-7-5-4-6-8-10/h3-9,11H,1H2,2H3/t9-,11+/m1/s1
InChIKey PXRCVUOBOXKQDO-KOLCDFICSA-N
Literature Reference DOI 10.1021/jo400663d
Molecular Weight 191.230 g/mol
SMILES c1cc([C@@](C=C)([C@]([N+](=O)[O-])(C)[H])[H])ccc1
SPLASH splash10-00mo-2900000000-491ba5455ac794ccf27d
Source of Spectrum J-78-6505-2a
Synonyms ((3R,4R)-4-nitropent-1-en-3-yl)benzene [(3R,4R)-4-nitropent-1-en-3-yl]benzene
Wiley ID 1745515