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(5S,6R)-5-Nitro-6-octylpiperidin-2-one

View entire compound with spectra: 1 MS (GC)

(5S,6R)-5-Nitro-6-octylpiperidin-2-one
SpectraBase Compound ID J5mZ2dLB3bI
InChI InChI=1S/C13H24N2O3/c1-2-3-4-5-6-7-8-11-12(15(17)18)9-10-13(16)14-11/h11-12H,2-10H2,1H3,(H,14,16)/t11-,12+/m1/s1
InChIKey MNABDYATFBKMLV-NEPJUHHUSA-N
Mol Weight 256.35 g/mol
Molecular Formula C13H24N2O3
Exact Mass 256.178693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KwTrj5s3G0z
Name (5S,6R)-5-Nitro-6-octylpiperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24N2O3
InChI InChI=1S/C13H24N2O3/c1-2-3-4-5-6-7-8-11-12(15(17)18)9-10-13(16)14-11/h11-12H,2-10H2,1H3,(H,14,16)/t11-,12+/m1/s1
InChIKey MNABDYATFBKMLV-NEPJUHHUSA-N
Literature Reference DOI 10.3987/COM-14-S(K)103
Molecular Weight 256.346 g/mol
SMILES N1C(CC[C@@]([C@]1(CCCCCCCC)[H])([N+](=O)[O-])[H])=O
SPLASH splash10-03dj-5900000000-5fc007266439dedb3b77
Source of Spectrum H1-90-1429-trans_(10c)
Wiley ID 1755508