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5-Phenyl-2-[2-[[5-phenyl-3-(3-sulfopropyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(3-sulfopropyl)benzoxazolium hydroxide inner salt, sodium salt

Compound with spectra: 2 NMR, and 1 FTIR

5-Phenyl-2-[2-[[5-phenyl-3-(3-sulfopropyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(3-sulfopropyl)benzoxazolium hydroxide inner salt, sodium salt
SpectraBase Compound ID CN2njSpM4v1
InChI InChI=1S/C37H36N2O8S2.Na/c1-2-27(23-36-38(19-9-21-48(40,41)42)32-25-30(15-17-34(32)46-36)28-11-5-3-6-12-28)24-37-39(20-10-22-49(43,44)45)33-26-31(16-18-35(33)47-37)29-13-7-4-8-14-29;/h3-8,11-18,23-26H,2,9-10,19-22H2,1H3,(H-,40,41,42,43,44,45);/q;+1/p-1
InChIKey MDBAEQGNAMHPTI-UHFFFAOYSA-M
Mol Weight 722.80276928 g/mol
Molecular Formula C37H35N2NaO8S2
Exact Mass 722.173253 g/mol
Parent InChIKey WBJFYAXVVHNETH-UHFFFAOYSA-M

View Spectrum of 5-Phenyl-2-[2-[[5-phenyl-3-(3-sulfopropyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(3-sulfopropyl)benzoxazolium hydroxide inner salt, sodium salt

ATR-IR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 386197

View Spectrum of 5-Phenyl-2-[2-[[5-phenyl-3-(3-sulfopropyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(3-sulfopropyl)benzoxazolium hydroxide inner salt, sodium salt

13C NMR Spectrum
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 386197
Solvent DMSO-d6

View Spectrum of 5-Phenyl-2-[2-[[5-phenyl-3-(3-sulfopropyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(3-sulfopropyl)benzoxazolium hydroxide inner salt, sodium salt

1H NMR Spectrum
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Co. LLC.
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 386197
Solvent DMSO-d6
5-Phenyl-2-[2-[[5-phenyl-3-(4-sulfobutyl)-2(3H)-benzoxazolylidene]methyl]-1-butenyl]-3-(4-sulfobutyl)benzoxazolium hydroxide inner salt, sodium salt
(22S,23S)-2.alpha.,3.alpha.,22,23-Diepoxy-5.alpha.-stigmast-6-one
4H-1-Benzopyran-4-one, 5,7-bis(acetyloxy)-6-[[2,6-bis(acetyloxy)-4-methoxy-3-methylphenyl]ph enylmethyl]-2,3-dihydro-8-methyl-2-phenyl-
(22R,23R)-2.alpha.,3.alpha.,22,23-Diepoxy-5.alpha.-stigmast-6-one
2,2'-DIACETOXY-5,5'-DI-TERT.-BUTYL-3,3'-BIS-[(2S,4S)-3-(4-METHYLBENZENESULFONYL)-4-(1-METHYLETHYL)-1,3-OXAZOLIDINYL]-BIPHENYL
Austrodorin A
5,7,4'-TRIHYDROXY-3,6,8,2',5'-PENTAMETHOXYFLAVONE
1-Phenyl-3-methyl-5-(methoxycarbonyl)-6-[(4-methylphenylamino)(4-methylphenylimino)methyl]-7-methoxy)pyrazolo[3,4-d][1,3]diazepine
(+-)-9-Benzyl-5,7-dichloro-8-methyl-2-phenyl-3,4,9,9a-tetrahydro-1H-pyrrolo[3,4-g]isoquinoline-1,3(2H)-dione
Eupatochinilide V
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