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Anti-4-Nitro-3-phenylhexanal
SpectraBase Compound ID FsZ9Jd8oNJG
InChI InChI=1S/C12H15NO3/c1-2-12(13(15)16)11(8-9-14)10-6-4-3-5-7-10/h3-7,9,11-12H,2,8H2,1H3/t11-,12-/m1/s1
InChIKey GMHCNVBDYWBRTC-VXGBXAGGSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lgb9DsXOWow
Name Anti-4-Nitro-3-phenylhexanal
Alternate Name(s) (3R,4R)-4-nitro-3-phenylhexanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-2-12(13(15)16)11(8-9-14)10-6-4-3-5-7-10/h3-7,9,11-12H,2,8H2,1H3/t11-,12-/m1/s1
InChIKey GMHCNVBDYWBRTC-VXGBXAGGSA-N
Literature Reference DOI 10.1002/adsc.200600316
Molecular Weight 221.256 g/mol
SMILES [C@](CC)([C@@](c1ccccc1)(CC=O)[H])([N+](=O)[O-])[H]
SPLASH splash10-05al-4900000000-cade077dda858516ef06
Source of Spectrum ASC-349-746-746_3
Wiley ID 1765511