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Details
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Molecule | 60004995 |
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| Chemical name(s) | butyl acrylate; Butyl prop-2-enoate
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| Chemical formula | C7H12O2 |
| Molecular weight | 128.169 |
| Number of double bond equivalents (DBEs) | 2.0 |
| Number of all rings, size of smallest set of smallest rings | 0, 0 |
| Canonical name(s) |
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| CAS-Number |
141-32-2
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| Additional information |
Links from Unichem: ChEMBL;KEGG (Kyoto Encyclopedia of Genes and Genomes) Ligand;ChEBI (Chemical Entities of Biological Interest).;ZINC;eMolecules;IBM strategic IP insight platform and the National Institutes of Health;F... (truncated)
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| Molecule keywords | |
| DOI | 10.18716/nmrshiftdb2/60004995 |
1H Spectrum | 60004158
Rating: 10 (10: 10: nmrshiftdb2 quality check: accept/reliability: excellent (admin)) |
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| Type | 1H |
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Measurement conditions
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| Temperature [K] | 300 |
| Solvent | H2O+D2O |
| Field Strength [MHz] | 150.90280151367188 |
| Assignment Method | 1H, 1H, H,H-COSY, H,C-HSQC, 1H, 1H |
| Literature |
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| Additional comments | Data from Ruhr University Bochum, Laboratory Prof. R. Stoll |
| nmrshiftdb2 quality report |
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| Additional information |
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| Spectrum categories | chemie koeln;RUB |
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