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[(2-piperidinoethyl)thio]phenylacetic acid, isopropyl ester, citrate (1:1) (salt)
SpectraBase Compound ID FUG9lMYLDut
InChI InChI=1S/C18H27NO2S.C6H8O7/c1-15(2)21-18(20)17(16-9-5-3-6-10-16)22-14-13-19-11-7-4-8-12-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h3,5-6,9-10,15,17H,4,7-8,11-14H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey BSMOYAUVCMZNSH-UHFFFAOYSA-N
Mol Weight 513.6 g/mol
Molecular Formula C24H35NO9S
Exact Mass 513.203253 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6UqRQ43m28k
Name [(2-PIPERIDINOETHYL)THIO]PHENYLACETIC ACID, ISOPROPYL ESTER, CITRATE (1:1) (SALT)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S42297
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H35NO9S
InChI InChI=1S/C18H27NO2S.C6H8O7/c1-15(2)21-18(20)17(16-9-5-3-6-10-16)22-14-13-19-11-7-4-8-12-19;7-3(8)1-6(13,5(11)12)2-4(9)10/h3,5-6,9-10,15,17H,4,7-8,11-14H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey BSMOYAUVCMZNSH-UHFFFAOYSA-N
Molecular Weight 513.601990
Synonyms ACETIC ACID, //2-PIPERIDINOETHYL/- THIO/PHENYL-, ISOPROPYL ESTER, CITRATE /1 TO 1/ /SALT/
Technique FILM (CAST FROM CHCl3)