| SpectraBase Compound ID | FxHMshoGEfG |
|---|---|
| InChI | InChI=1S/C19H22O4/c1-10(9-20)14-16(21)12-6-7-13-11(5-4-8-19(13,2)3)15(12)18(23)17(14)22/h6-7,10,20,22H,4-5,8-9H2,1-3H3 |
| InChIKey | PKEGICXVZMKJPR-UHFFFAOYSA-N |
| Mol Weight | 314.38 g/mol |
| Molecular Formula | C19H22O4 |
| Exact Mass | 314.151809 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J80MDVm5XHu |
|---|---|
| Name | Neocrypto-tanshinone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H22O4 |
| InChI | InChI=1S/C19H22O4/c1-10(9-20)14-16(21)12-6-7-13-11(5-4-8-19(13,2)3)15(12)18(23)17(14)22/h6-7,10,20,22H,4-5,8-9H2,1-3H3 |
| InChIKey | PKEGICXVZMKJPR-UHFFFAOYSA-N |
| Molecular Weight | 314.381 g/mol |
| SMILES | OCC(C1=C(C(c2c(C1=O)ccc1c2CCCC1(C)C)=O)O)C |
| SPLASH | splash10-001i-0293000000-cae0f6c8806215a47830 |
| Source of Spectrum | X2-50-159-2 |
| Wiley ID | 1602178 |