SpectraBase Compound ID | 1erbqVr6sQA |
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InChI | InChI=1S/C17H15N3O3S2/c1-22-12-9-7-11(8-10-12)20-17(25-15(19-20)16(21)23-2)18-13-5-3-4-6-14(13)24-17/h3-10,18H,1-2H3 |
InChIKey | PNZBHDGDDYMDEJ-UHFFFAOYSA-N |
Mol Weight | 373.45 g/mol |
Molecular Formula | C17H15N3O3S2 |
Exact Mass | 373.055484 g/mol |
SpectraBase Spectrum ID | CVWiZ3fg5qX |
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Name | methyl 4-(4-methoxyphenyl)spiro[1,3,4-thiadiazole-5,2'-3H-1,3-benzothiazole]-2-carboxylate 4-(4-methoxyphenyl)-2-spiro[1,3,4-thiadiazole-5,2'-3H-1,3-benzothiazole]carboxylic acid methyl ester 4-(4-methoxyphenyl)spiro[1,3,4-thiadiazole-5,2'-3H-1,3-benzothiazole]-2-carboxylic acid methyl ester |
Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 373.055483700 u |
Formula | C17H15N3O3S2 |
InChI | InChI=1S/C17H15N3O3S2/c1-22-12-9-7-11(8-10-12)20-17(25-15(19-20)16(21)23-2)18-13-5-3-4-6-14(13)24-17/h3-10,18H,1-2H3 |
InChIKey | PNZBHDGDDYMDEJ-UHFFFAOYSA-N |
Molecular Weight | 373.445 g/mol |
NMR Offset | 18.0068 |
NMR Spectrometer Frequency | 500.134 |
Observed nucleus | 1H |
Sample State | Soluted |
Sample_ID | 1H_CB_2017_12175 |
Solvent | DMSO-d6 |
Source | Vendor ID: NMR/10271604; Lab Info: LP; Lab Number: LP-0302245 |