| SpectraBase Compound ID | GkbcwWuK27i |
|---|---|
| InChI | InChI=1S/C11H9BrN4O3/c12-6-3-5-4(7-10(18)16-11(19)15-7)1-2-13-9(17)8(5)14-6/h3,14H,1-2H2,(H,13,17)(H2,15,16,18,19)/b7-4- |
| InChIKey | LEWMERXWKZWRBX-DAXSKMNVSA-N |
| Mol Weight | 325.12 g/mol |
| Molecular Formula | C11H9BrN4O3 |
| Exact Mass | 323.985803 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EfMKAeFLo33 |
|---|---|
| Name | SPONGIACIDIN_D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H9BrN4O3 |
| InChI | InChI=1S/C11H9BrN4O3/c12-6-3-5-4(7-10(18)16-11(19)15-7)1-2-13-9(17)8(5)14-6/h3,14H,1-2H2,(H,13,17)(H2,15,16,18,19)/b7-4- |
| InChIKey | LEWMERXWKZWRBX-DAXSKMNVSA-N |
| Literature Reference Author | K.INABA,H.SATO,M.TSUDA,J.KOBAYASHI |
| Literature Reference Citation | J.NAT.PROD.,61,693(1998) |
| Literature Reference DOI | 10.1021/np970565h |
| Molecular Weight | 325.121 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWMZ583 |