| SpectraBase Compound ID | 76z7dyFTtmE |
|---|---|
| InChI | InChI=1S/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10?/m0/s1 |
| InChIKey | PCYQRXYBKKZUSR-RGURZIINSA-N |
| Mol Weight | 218.26 g/mol |
| Molecular Formula | C12H14N2O2 |
| Exact Mass | 218.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Fbmkaj7VTZY |
|---|---|
| Name | Cytisin, N-formyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 218.105527697 u |
| Formula | C12H14N2O2 |
| InChI | InChI=1S/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10?/m0/s1 |
| InChIKey | PCYQRXYBKKZUSR-RGURZIINSA-N |
| Molecular Weight | 218.256 g/mol |
| SMILES | C1(=O)C=CC=C2N1C[C@]1(CC2CN(C1)C=O)[H] |