SpectraBase Spectrum ID |
Ddjm1HMjcb9 |
Name |
(3S)-3-[(Methoxymethyl)oxy]-3-methyl-1,2,3,4-tetrahydrobenzo[A]anthracene-7,12-dione |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
336.136159120 u |
Formula |
C21H20O4 |
InChI |
InChI=1S/C21H20O4/c1-21(25-12-24-2)10-9-14-13(11-21)7-8-17-18(14)20(23)16-6-4-3-5-15(16)19(17)22/h3-8H,9-12H2,1-2H3/t21-/m0/s1 |
InChIKey |
COFBUYSDPHJPRR-NRFANRHFSA-N |
Molecular Weight |
336.387 g/mol |
SMILES |
C=12C(C=3C=CC=CC3C(C2=CC=C2C1CC[C@@](OCOC)(C)C2)=O)=O |