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1-(2-Nitro-1-phenylethyl)-2-oxocyclopentanecarboxylic acid, methyl ester
SpectraBase Compound ID 75eZTQUTh55
InChI InChI=1S/C15H17NO5/c1-21-14(18)15(9-5-8-13(15)17)12(10-16(19)20)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3
InChIKey PXQWCBKEMHAYSE-UHFFFAOYSA-N
Mol Weight 291.3 g/mol
Molecular Formula C15H17NO5
Exact Mass 291.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KP3zCXBOpIZ
Name 1-(2-NITRO-1-PHENYLETHYL)-2-OXO-CYCLOPENTANECARBOXYLIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H17NO5
InChI InChI=1S/C15H17NO5/c1-21-14(18)15(9-5-8-13(15)17)12(10-16(19)20)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3
InChIKey PXQWCBKEMHAYSE-UHFFFAOYSA-N
Molecular Weight 291.1102
SMILES C1CC(C(CN(=O)=O)c2ccccc2)(C(OC)=O)C(=O)C1
SPLASH splash10-004l-4900000000-bc2c1cf5753564264daf
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany