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Details
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Molecule | 21156 |
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| Chemical name(s) | 2-(ethylsulfonyl)-1,3-benzothiazole
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| Chemical formula | C9H9NO2S2 |
| Molecular weight | 227.303 |
| Number of double bond equivalents (DBEs) | 6.0 |
| Number of all rings, size of smallest set of smallest rings | 3, 2 |
| Canonical name(s) |
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| CAS-Number |
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| Additional information |
Deposition in PubChem;
Compound in PubChem;
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| Molecule keywords | |
Spectrum | 57909
Rating: 10 |
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| Type | 13C |
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Measurement conditions
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| Temperature [K] | 298 |
| Solvent | Chloroform-D1 (CDCl3) |
| Field Strength [MHz] | 100.6 |
| Assignment Method | hmqc / hmbc |
| Literature |
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| Additional comments | mzdiv855; Multiplicities generated automatically from H count |
| Additional information |
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| Spectrum categories | ocmainz inhouse database |
Spectrum | 20115727
Rating: 10 |
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| Type | 1H |
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Measurement conditions
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| Assignment Method | Unreported |
| Field Strength [MHz] | Unreported |
| Temperature [K] | Unreported |
| Solvent | Unreported |
| Literature |
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| Additional comments | 854.MOL.MZ3H |
| Additional information |
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| Spectrum categories | ocmainz inhouse-2 |
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