SpectraBase Spectrum ID |
KxDWpGSFmo3 |
Name |
ROTENON |
CAS Registry Number |
83-79-4 |
Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
Exact Mass |
394.141638422 u |
Formula |
C23H22O6 |
InChI |
InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3 |
InChIKey |
JUVIOZPCNVVQFO-UHFFFAOYSA-N |
Molecular Weight |
394.423 g/mol |
Nominal Mass |
394 u |
Number of Peaks |
136 |
SMILES |
COc1cc2c(cc1OC)OCC1C2C(c2c(O1)c1c(cc2)OC(C1)C(C)=C)=O |
SPLASH |
splash10-0006-2935000000-24a2282bb4d9e831d09e |
Source of Spectrum |
Dr. Rolf Kuehnle |
Synonyms |
2-isopropenyl-8,9-dimethoxy-1,2,12,12a-tetrahydrochromeno[3,4-b]furo[2,3-h]chromen-6(6aH)-one |
Technique |
GC/MS |
Wiley ID |
WID_MSPA_3478 |