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1-(2'-nitrocyclopentyl)-1-phenyl-2-propanone
SpectraBase Compound ID 6b0lbQyZLYk
InChI InChI=1S/C14H17NO3/c1-10(16)14(11-6-3-2-4-7-11)12-8-5-9-13(12)15(17)18/h2-4,6-7,12-14H,5,8-9H2,1H3
InChIKey ICDLVLSAKNRQTF-UHFFFAOYSA-N
Mol Weight 247.29 g/mol
Molecular Formula C14H17NO3
Exact Mass 247.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEdi36OKe5T
Name 1-(2'-nitrocyclopentyl)-1-phenyl-2-propanone
Alternate Name(s) 1-(2-nitrocyclopentyl)-1-phenylacetone 1-Phenyl-1-(2-nitrocyclopentyl)-propan-2-one (stereoisomer) 1-Phenyl-1-(2-nitrocyclopentyl)-propan-2-one
CAS Registry Number 126924-84-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO3
InChI InChI=1S/C14H17NO3/c1-10(16)14(11-6-3-2-4-7-11)12-8-5-9-13(12)15(17)18/h2-4,6-7,12-14H,5,8-9H2,1H3
InChIKey ICDLVLSAKNRQTF-UHFFFAOYSA-N
Molecular Weight 247.294 g/mol
SMILES C1(N(=O)=O)C(C(C(=O)C)c2ccccc2)CCC1
SPLASH splash10-0006-9300000000-bbacfb4aec046fb879a2
Source of Spectrum F-45-5676-7
Wiley ID 1250036