| SpectraBase Compound ID | 3Ihnkag8Iea |
|---|---|
| InChI | InChI=1S/C17H13ClN4O3/c1-25-17(24)15(22-21-11-6-4-5-10(18)9-11)14-16(23)20-13-8-3-2-7-12(13)19-14/h2-9,21H,1H3,(H,20,23)/b22-15- |
| InChIKey | RUDDCNBYHGQYOX-JCMHNJIXSA-N |
| Mol Weight | 356.77 g/mol |
| Molecular Formula | C17H13ClN4O3 |
| Exact Mass | 356.067618 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5GBVPwfOFZI |
|---|---|
| Compound Number | 2C |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C17H13ClN4O3/c1-25-17(24)15(22-21-11-6-4-5-10(18)9-11)14-16(23)20-13-8-3-2-7-12(13)19-14/h2-9,21H,1H3,(H,20,23)/b22-15- |
| InChIKey | RUDDCNBYHGQYOX-JCMHNJIXSA-N |
| Literature Reference | Y.KURASAWA,A.TAKANO,K.KATO,H.S.KIM,Y.OKAMOTO J.HETCYCL.CHEM.,34,305(1997) |
| Solvent | Dimethyl sulfoxide-d6 |
| Technique | C/H SHIFT CORRELATION |