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2-(2-Nitro-1-p-tolyl-ethyl)-cyclohexanone
SpectraBase Compound ID BlUiWiP0Yni
InChI InChI=1S/C15H19NO3/c1-11-6-8-12(9-7-11)14(10-16(18)19)13-4-2-3-5-15(13)17/h6-9,13-14H,2-5,10H2,1H3
InChIKey PHEULLPBBMBXSS-UHFFFAOYSA-N
Mol Weight 261.32 g/mol
Molecular Formula C15H19NO3
Exact Mass 261.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AEzAfjY5M2P
Name 2-(2-NITRO-1-p-TOLYL-ETHYL)-CYCLOHEXANONE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H19NO3
InChI InChI=1S/C15H19NO3/c1-11-6-8-12(9-7-11)14(10-16(18)19)13-4-2-3-5-15(13)17/h6-9,13-14H,2-5,10H2,1H3
InChIKey PHEULLPBBMBXSS-UHFFFAOYSA-N
Molecular Weight 261.1360
SMILES C1C(=O)C(C(CN(=O)=O)c2ccc(C)cc2)CCC1
SPLASH splash10-02ti-2910000000-121c8072e2927dcd1d29
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany