![4,5-DIAMINO-2-METHYL-10BH-[1]-BENZOPYRANO-[3,4-C]-PYRIDINE-3-CARBONITRILE](/api/spectrum/3xPrmi4BnR2/structure.png?h=300&w=458 "4,5-DIAMINO-2-METHYL-10BH-[1]-BENZOPYRANO-[3,4-C]-PYRIDINE-3-CARBONITRILE")
| SpectraBase Compound ID | ExP4aPSSYnc |
|---|---|
| InChI | InChI=1S/C14H12N4O/c1-7-9(6-15)11-8-4-2-3-5-10(8)19-14(17)12(11)13(16)18-7/h2-5,11H,17H2,1H3,(H2,16,18) |
| InChIKey | QFTSDNXSBVPGCK-UHFFFAOYSA-N |
| Mol Weight | 252.28 g/mol |
| Molecular Formula | C14H12N4O |
| Exact Mass | 252.101111 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3xPrmi4BnR2 |
|---|---|
| Name | 4,5-DIAMINO-2-METHYL-10BH-[1]-BENZOPYRANO-[3,4-C]-PYRIDINE-3-CARBONITRILE |
| Compound Number | 10 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C14H12N4O/c1-7-9(6-15)11-8-4-2-3-5-10(8)19-14(17)12(11)13(16)18-7/h2-5,11H,17H2,1H3,(H2,16,18) |
| InChIKey | QFTSDNXSBVPGCK-UHFFFAOYSA-N |
| Literature Reference | C.N.OCALLAGHAN,T.B.H.MCMURRY,J.E.OBRIEN J.CHEM.SOC.PERKIN-1,417(1995) |
| Solvent | Dimethyl sulfoxide-d6 |