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3-methyl-2-phenylvaleric acid, methyl-4-piperidyl ester, fumarate(1:1)
SpectraBase Compound ID EgV9uhzvmUf
InChI InChI=1S/C18H27NO2.C4H4O4/c1-4-14(2)17(15-8-6-5-7-9-15)18(20)21-16-10-12-19(3)13-11-16;5-3(6)1-2-4(7)8/h5-9,14,16-17H,4,10-13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey GWJUCAVUXFGRGO-WLHGVMLRSA-N
Mol Weight 405.49 g/mol
Molecular Formula C22H31NO6
Exact Mass 405.215138 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LgzmRWPu4wh
Name 3-METHYL-2-PHENYLVALERIC ACID, METHYL-4-PIPERIDYL ESTER, FUMARATE (1:1)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S39833
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO6
InChI InChI=1S/C18H27NO2.C4H4O4/c1-4-14(2)17(15-8-6-5-7-9-15)18(20)21-16-10-12-19(3)13-11-16;5-3(6)1-2-4(7)8/h5-9,14,16-17H,4,10-13H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey GWJUCAVUXFGRGO-WLHGVMLRSA-N
Molecular Weight 405.490997
Synonyms VALERIC ACID, 3-METHYL-2-PHENYL-, 1-METHYL-4-PIPERIDYL ESTER, FUMARATE /1 TO 1/
Technique FILM (CAST FROM CHCl3)