![[2,5-Dimethoxy-4-(2,5-dimethoxybenzyl)-2,5-cyclohexadienylidene]methyl 3.5-Dinitrobebzoate](/api/spectrum/5LONgGpnDNl/structure.png?h=300&w=458 "[2,5-Dimethoxy-4-(2,5-dimethoxybenzyl)-2,5-cyclohexadienylidene]methyl 3.5-Dinitrobebzoate")
| SpectraBase Compound ID | APRacLzv5bc |
|---|---|
| InChI | InChI=1S/C25H24N2O10/c1-33-21-5-6-22(34-2)15(10-21)7-16-11-24(36-4)18(12-23(16)35-3)14-37-25(28)17-8-19(26(29)30)13-20(9-17)27(31)32/h5-6,8-14,16H,7H2,1-4H3/b18-14- |
| InChIKey | YHSWCJMUVKKTPX-JXAWBTAJSA-N |
| Mol Weight | 512.47 g/mol |
| Molecular Formula | C25H24N2O10 |
| Exact Mass | 512.143095 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5LONgGpnDNl |
|---|---|
| Name | [2,5-Dimethoxy-4-(2,5-dimethoxybenzyl)-2,5-cyclohexadienylidene]methyl 3.5-Dinitrobebzoate |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H24N2O10 |
| InChI | InChI=1S/C25H24N2O10/c1-33-21-5-6-22(34-2)15(10-21)7-16-11-24(36-4)18(12-23(16)35-3)14-37-25(28)17-8-19(26(29)30)13-20(9-17)27(31)32/h5-6,8-14,16H,7H2,1-4H3/b18-14- |
| InChIKey | YHSWCJMUVKKTPX-JXAWBTAJSA-N |
| Molecular Weight | 512.471 g/mol |
| SMILES | c1(N(=O)=O)cc(N(=O)=O)cc(c1)C(O\C=C\1C=C(OC)C(C=C1OC)Cc1c(ccc(c1)OC)OC)=O |
| SPLASH | splash10-014i-0900000000-d4c882784f44140a8991 |
| Source of Spectrum | J-62-4648-20 |
| Synonyms | (Z)-[4-(2,5-dimethoxybenzyl)-2,5-dimethoxy-2,5-cyclohexadien-1-ylidene]methyl 3,5-dinitrobenzoate 3,5-dinitrobenzoic acid[(Z)-[4-(2,5-dimethoxybenzyl)-2,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene]methyl]ester 3,5-dinitrobenzoic acid[(Z)-[4-[(2,5-dimethoxyphenyl)methyl]-2,5-dimethoxy-1-cyclohexa-2,5-dienylidene]methyl]ester [(Z)-[4-[(2,5-dimethoxyphenyl)methyl]-2,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene]methyl]3,5-dinitrobenzoate 3,5-dinitrobenzoic acid [(Z)-[4-[(2,5-dimethoxyphenyl)methyl]-2,5-dimethoxy-1-cyclohexa-2,5-dienylidene]methyl] ester [(Z)-[4-[(2,5-dimethoxyphenyl)methyl]-2,5-dimethoxycyclohexa-2,5-dien-1-ylidene]methyl] 3,5-dinitrobenzoate [(Z)-[4-[(2,5-dimethoxyphenyl)methyl]-2,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene]methyl] 3,5-dinitrobenzoate |
| Wiley ID | 1400763 |