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2-[(Heptyl-methyl-carbamoyl)-methyl]-malonic acid, diethyl ester

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2-[(Heptyl-methyl-carbamoyl)-methyl]-malonic acid, diethyl ester
SpectraBase Compound ID 8ob2Q9ek8o4
InChI InChI=1S/C17H31NO5/c1-5-8-9-10-11-12-18(4)15(19)13-14(16(20)22-6-2)17(21)23-7-3/h14H,5-13H2,1-4H3
InChIKey JRIIAPKMYOPMMK-UHFFFAOYSA-N
Mol Weight 329.44 g/mol
Molecular Formula C17H31NO5
Exact Mass 329.220223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuVBL18TddZ
Name 2-[(HEPTYLMETHYLCARBAMOYL)METHYL]MALONIC ACID, DIETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H31NO5
InChI InChI=1S/C17H31NO5/c1-5-8-9-10-11-12-18(4)15(19)13-14(16(20)22-6-2)17(21)23-7-3/h14H,5-13H2,1-4H3
InChIKey JRIIAPKMYOPMMK-UHFFFAOYSA-N
Molecular Weight 329.2194
SMILES CCCCCCCN(C(CC(C(OCC)=O)C(OCC)=O)=O)C
SPLASH splash10-0kou-8960000000-aae2c076cf3446d05855
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany