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Cyclohexanone, 2-(2-methyl-2-nitropropyl)-6-(phenylmethylene)-
SpectraBase Compound ID 4HWC3b47I3q
InChI InChI=1S/C17H21NO3/c1-17(2,18(20)21)12-15-10-6-9-14(16(15)19)11-13-7-4-3-5-8-13/h3-5,7-8,11,15H,6,9-10,12H2,1-2H3/b14-11+
InChIKey HFRDIYMUBVDOQR-SDNWHVSQSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ix4tAEHeDPP
Name Cyclohexanone, 2-(2-methyl-2-nitropropyl)-6-(phenylmethylene)-
CAS Registry Number 78354-75-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-17(2,18(20)21)12-15-10-6-9-14(16(15)19)11-13-7-4-3-5-8-13/h3-5,7-8,11,15H,6,9-10,12H2,1-2H3/b14-11+
InChIKey HFRDIYMUBVDOQR-SDNWHVSQSA-N
Molecular Weight 287.359 g/mol
SMILES C(N(=O)=O)(CC1C(\C(=C\c2ccccc2)CCC1)=O)(C)C
SPLASH splash10-00lu-2910000000-17ca132961ca8ea2891f
Source of Spectrum B-37-125-0
Wiley ID 1290889