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4-decyl-2,5,5-trimethyl-1-oxido-1-pyrrolin-1-ium-3-carboxylic acid ethyl ester
SpectraBase Compound ID IriZPogDiQ6
InChI InChI=1S/C20H37NO3/c1-6-8-9-10-11-12-13-14-15-17-18(19(22)24-7-2)16(3)21(23)20(17,4)5/h17-18H,6-15H2,1-5H3
InChIKey IZYCPYMXVVCPDQ-UHFFFAOYSA-N
Mol Weight 339.5 g/mol
Molecular Formula C20H37NO3
Exact Mass 339.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDSGqGELxn7
Name 4-decyl-2,5,5-trimethyl-1-oxido-1-pyrrolin-1-ium-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H37NO3
InChI InChI=1S/C20H37NO3/c1-6-8-9-10-11-12-13-14-15-17-18(19(22)24-7-2)16(3)21(23)20(17,4)5/h17-18H,6-15H2,1-5H3
InChIKey IZYCPYMXVVCPDQ-UHFFFAOYSA-N
Molecular Weight 339.520 g/mol
SMILES C1(=[N+](C(C(C1C(=O)OCC)CCCCCCCCCC)(C)C)[O-])C
SPLASH splash10-0006-9310000000-1ce47d546ed9cb07229c
Source of Spectrum SO-0-1499-2
Synonyms 4-decyl-2,5,5-trimethyl-1-oxido-3,4-dihydropyrrol-1-ium-3-carboxylic acid ethyl ester Ethyl 4-decyl-2,5,5-trimethyl-1-oxidanidyl-3,4-dihydropyrrol-1-ium-3-carboxylate Ethyl 4-decyl-2,5,5-trimethyl-1-oxido-3,4-dihydropyrrol-1-ium-3-carboxylate
Wiley ID 875953