20170320_JVN-240868-2.VNMRS[PROTON_01.fid]
URL: http://nmrxiv.org/D5215
Dataset description:
This dataset contains NMR spectra obtained for the sample -20170320_JVN-240868-2.VNMRS name: PROTON_01.fid phc0: 49.3840120064 isFid: true nucleus: 1H solvent: cdcl3 dimension: 1...
Source: 20170320_JVN-240868-2.VNMRS[PROTON_01.fid]
Chemical Info
| InChI |
InChI=1S/C14H18O2/c1-9-4-3-5-11-7-12-10(6-13(15)16-12)8-14(9,11)2/h5-6,9,12H,3-4,7-8H2,1-2H3/t9-,12+,14+/m0/s1 |
| SMILES |
C[C@H]1CCC=C2C[C@H]3OC(=O)C=C3C[C@@]21C |
| InChI Key |
GTAPBZFGNAGOQE-MRCXROJRSA-N |
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