| SpectraBase Compound ID | 7CC8Jsfvi8G |
|---|---|
| InChI | InChI=1S/C13H23N3O8S/c1-5(18)14-10(13(2,3)25-16-23)11(21)15-7-9(20)8(19)6(4-17)24-12(7)22/h6-10,12,17,19-20,22H,4H2,1-3H3,(H,14,18)(H,15,21)/t6-,7+,8-,9-,10-,12+/m0/s1 |
| InChIKey | MPJKBQQBYUJGPA-PVBSVYKBSA-N |
| Mol Weight | 381.4 g/mol |
| Molecular Formula | C13H23N3O8S |
| Exact Mass | 381.120586 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LmAKGcvzjww |
|---|---|
| Name | MAN-2-SNAP |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H23N3O8S |
| InChI | InChI=1S/C13H23N3O8S/c1-5(18)14-10(13(2,3)25-16-23)11(21)15-7-9(20)8(19)6(4-17)24-12(7)22/h6-10,12,17,19-20,22H,4H2,1-3H3,(H,14,18)(H,15,21)/t6-,7+,8-,9-,10-,12+/m0/s1 |
| InChIKey | MPJKBQQBYUJGPA-PVBSVYKBSA-N |
| Literature Reference Author | X.WU,X.TANG,M.XIAN,P.G.BRAUSCHWEIGER,P.G.WANG |
| Literature Reference Citation | BIOORG.MED.CHEM.,10,2303(2002) |
| Literature Reference DOI | 10.1016/S0968-0896(02)00064-0 |
| Molecular Weight | 381.401 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN28425 |