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{[2-(diethylamino)ethyl]thio}phenylacetic acid, veratryl ester, citrate(1:1)
SpectraBase Compound ID 6CXnmc8bk5p
InChI InChI=1S/C23H31NO4S.C6H8O7/c1-5-24(6-2)14-15-29-22(19-10-8-7-9-11-19)23(25)28-17-18-12-13-20(26-3)21(16-18)27-4;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-13,16,22H,5-6,14-15,17H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey QQKHZPMMQVTPCM-UHFFFAOYSA-N
Mol Weight 609.69 g/mol
Molecular Formula C29H39NO11S
Exact Mass 609.224382 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 2lGT274XtMA
Name {[2-(DIETHYLAMINO)ETHYL]THIO}PHENYLACETIC ACID, VERATRYL ESTER, CITRATE (1:1)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S39848
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H39NO11S
InChI InChI=1S/C23H31NO4S.C6H8O7/c1-5-24(6-2)14-15-29-22(19-10-8-7-9-11-19)23(25)28-17-18-12-13-20(26-3)21(16-18)27-4;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-13,16,22H,5-6,14-15,17H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey QQKHZPMMQVTPCM-UHFFFAOYSA-N
Molecular Weight 609.687012
Synonyms ACETIC ACID, //2-/DIETHYLAMINO/- ETHYL/THIO/PHENYL-, VERATRYL ESTER, CITRATE /1 TO 1/
Technique FILM (CAST FROM CHCl3)