| SpectraBase Compound ID | Bhnpuaodn5N |
|---|---|
| InChI | InChI=1S/C16H17NO4/c18-10-1-2-16-11-5-13-12(20-8-21-13)3-9(11)6-17(7-15(16)19)14(16)4-10/h1-3,5,10,14-15,18-19H,4,6-8H2/t10-,14+,15-,16-/m0/s1 |
| InChIKey | KWAOMPWGIIXDPH-YVFQKMDQSA-N |
| Mol Weight | 287.31 g/mol |
| Molecular Formula | C16H17NO4 |
| Exact Mass | 287.115758 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7Uq6ScWJBNo |
|---|---|
| Name | Hamayne |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H17NO4 |
| InChI | InChI=1S/C16H17NO4/c18-10-1-2-16-11-5-13-12(20-8-21-13)3-9(11)6-17(7-15(16)19)14(16)4-10/h1-3,5,10,14-15,18-19H,4,6-8H2/t10-,14+,15-,16-/m0/s1 |
| InChIKey | KWAOMPWGIIXDPH-YVFQKMDQSA-N |
| Instrument Name | Agilent 6890N GC 5975 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/acs.jnatprod.5b00785 |
| Molecular Weight | 287.315 g/mol |
| SMILES | O[C@@]1(C[C@]2(N3Cc4cc5c(cc4[C@@]2([C@](C3)(O)[H])C=C1)OCO5)[H])[H] |
| SPLASH | splash10-0a4i-0390000000-08e8abce428a6644b317 |
| Source of Spectrum | G4-79-1242-Hamayne |
| Wiley ID | 1849327 |