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2-Methyl-4-nitro-3-phenyl-butyric acid, methyl ester
SpectraBase Compound ID AoxIq8MyZJt
InChI InChI=1S/C12H15NO4/c1-9(12(14)17-2)11(8-13(15)16)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3
InChIKey FIPWMWABRFDZAV-UHFFFAOYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XI7hKFdtLn
Name 2-METHYL-4-NITRO-3-PHENYLBUTYRIC ACID, METHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-9(12(14)17-2)11(8-13(15)16)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3
InChIKey FIPWMWABRFDZAV-UHFFFAOYSA-N
Molecular Weight 237.0997
SMILES c1(C(C(C(OC)=O)C)CN(=O)=O)ccccc1
SPLASH splash10-003u-5900000000-fa2dcb2c0e200417ed68
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany