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4-methyl-4-nitrohexanoic acid, dodecyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

4-methyl-4-nitrohexanoic acid, dodecyl ester
SpectraBase Compound ID A3Dpa9uaf5f
InChI InChI=1S/C19H37NO4/c1-4-6-7-8-9-10-11-12-13-14-17-24-18(21)15-16-19(3,5-2)20(22)23/h4-17H2,1-3H3
InChIKey XDJAWIDWUMLDHF-UHFFFAOYSA-N
Mol Weight 343.5 g/mol
Molecular Formula C19H37NO4
Exact Mass 343.272259 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1pwdoorwa9j
Name 4-METHYL-4-NITROHEXANOIC ACID, DODECYL ESTER
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S56811
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H37NO4
InChI InChI=1S/C19H37NO4/c1-4-6-7-8-9-10-11-12-13-14-17-24-18(21)15-16-19(3,5-2)20(22)23/h4-17H2,1-3H3
InChIKey XDJAWIDWUMLDHF-UHFFFAOYSA-N
Molecular Weight 343.507996
Synonyms HEXANOIC ACID, 4-METHYL-4-NITRO-, DODECYL ESTER
Technique CAPILLARY CELL: NEAT