| SpectraBase Compound ID | 9pFCZHfq6AM |
|---|---|
| InChI | InChI=1S/C23H19N5O4/c1-11-20(30)28-15-9-5-3-7-13(15)23(32)10-16-19(29)25-18(26(11)22(23)28)17-24-14-8-4-2-6-12(14)21(31)27(16)17/h2-9,11,16,18,22,32H,10H2,1H3,(H,25,29)/t11-,16?,18?,22-,23+/m0/s1 |
| InChIKey | MLDFAXSXLVAFNZ-XJALIBQBSA-N |
| Mol Weight | 429.44 g/mol |
| Molecular Formula | C23H19N5O4 |
| Exact Mass | 429.143704 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C81wFTg0o0g |
|---|---|
| Name | COTTOQUINAZOLINE_A;COMPOUD-#1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H19N5O4 |
| InChI | InChI=1S/C23H19N5O4/c1-11-20(30)28-15-9-5-3-7-13(15)23(32)10-16-19(29)25-18(26(11)22(23)28)17-24-14-8-4-2-6-12(14)21(31)27(16)17/h2-9,11,16,18,22,32H,10H2,1H3,(H,25,29)/t11-,16?,18?,22-,23+/m0/s1 |
| InChIKey | MLDFAXSXLVAFNZ-XJALIBQBSA-N |
| Literature Reference Author | L.J.FREMLIN,A.M.PIGGOTT,E.LACEY,R.J.CAPON |
| Literature Reference Citation | J.NAT.PROD.,72,666(2009) |
| Literature Reference DOI | 10.1021/np800777f |
| Molecular Weight | 429.435 g/mol |
| Sample ID | 32405 |
| Solvent | DMSO-D6 |