| SpectraBase Spectrum ID |
I8KtsgwWDFD |
| Name |
2,7-di-epi-7-O-Methylcryptochinone A |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O5 |
| InChI |
InChI=1S/C18H18O5/c1-21-15-9-14-17(11-7-16(20)23-18(11)15)12(19)8-13(22-14)10-5-3-2-4-6-10/h2-6,11,13,15,18H,7-9H2,1H3/t11-,13+,15-,18-/m1/s1 |
| InChIKey |
CEQRNWQUBHZVDF-VPSJLMRDSA-N |
| Instrument Name |
Quatro |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np100014j |
| Molecular Weight |
314.337 g/mol |
| Optical Rotation |
[a]D25 = +96 (c = 0.40, CHCl3) |
| Reported Formula |
C18H18O5 |
| SMILES |
C1=2O[C@@](CC(C2[C@@]2([C@]([C@@](C1)(OC)[H])(OC(C2)=O)[H])[H])=O)(c1ccccc1)[H] |
| SPLASH |
splash10-0udi-2900000000-6d74d8c14e8db18e82d2 |
| Source of Spectrum |
G4-73-1475-5 |
| Wiley ID |
1849009 |
