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2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazolium hydroxide inner salt

Compound with spectra: 2 NMR, and 1 FTIR

2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazolium hydroxide inner salt
SpectraBase Compound ID CDxETMPhsDD
InChI InChI=1S/C25H26N2O2S2/c1-5-18(13-23-26(6-2)19-11-16(3)7-9-21(19)30-23)14-24-27(15-25(28)29)20-12-17(4)8-10-22(20)31-24/h7-14H,5-6,15H2,1-4H3
InChIKey FRMNAFRWMAEMRV-UHFFFAOYSA-N
Mol Weight 450.62 g/mol
Molecular Formula C25H26N2O2S2
Exact Mass 450.14357 g/mol

View Spectrum of 2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazolium hydroxide inner salt

ATR-IR Spectrum
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 386227

View Spectrum of 2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazolium hydroxide inner salt

13C NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 386227
Solvent DMSO-d6

View Spectrum of 2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazolium hydroxide inner salt

1H NMR Spectrum
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 386227
Solvent DMSO-d6
1-METHYL-2-[3-(1-METHYLNAPHTHO[1,2-d]THIAZOL-2(1H)-YLIDENE)PROPENYL]NAPHTHO[1,2-d]THIAZOLIUM IODIDE
3-Ethyl-2-[(3,4-dichlorophenyl)imino]-5-(5-methoxy-3-methyl-2(3H)-benzothiazolylidene)-4-thiazolidinone
2-(2-Hydroxyphenyl)-5-imino-4-thioxo-3,4-dihydro-5H-[1]benzopyrano[4,3-d]pyrimidin
1H-isoindole-5-carboxylic acid, 2,3-dihydro-2-(3-nitrophenyl)-1,3-dioxo-, 4-[9-[4-[[[2,3-dihydro-2-(3-nitrophenyl)-1,3-dioxo-1H-isoindol-5-yl]carbonyl]oxy]phenyl]-9H-fluoren-9-yl]phenyl ester
7-Ethyl-8-methyl-3-phenylchromeno[7,8-b][1,4]oxazin-6(3H)-one
3-pyridinecarbonitrile, 2-[[2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl]thio]-6-phenyl-4-(trifluoromethyl)-
N-cyclohexyl-2-[5-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)sulfanyl-1,2,4-triazol-1-yl]acetamide
2,3a,5,5-Tetramethyl-9-chloro-3a,4,5,6-tetrahydro-thiazolo[3,2-a]-[1,5]benzodiazepin-1(2H)-one
5,8,8-TRIMETHYL-2-(4-NITROPHENYL)-8,9-DIHYDROPYRAZOLO-[1,5-A]-QUINAZOLIN-6(7H)-ONE
4-[2-(1,3-benzodioxol-5-yl)-1,3-dithian-2-yl]-3-[hydroxy-(3,4,5-trimethoxyphenyl)methyl]-2-oxolanone
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