SpectraBase Spectrum ID |
CylBU4uRjNI |
Name |
Dispiro[furan-3(2H),2'(5'H)-furan-5',8''-[8H-4,8A]propano[1H-2]benzop yran]-3'',5(4H,4''H)-dione, 5''-(acetyloxy)hexahydro-4'',7''-dimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
406.199153299 u |
Formula |
C22H30O7 |
InChI |
InChI=1S/C22H30O7/c1-13-9-15(28-14(2)23)17-19(3)5-4-6-21(17,12-27-18(19)25)22(13)8-7-20(29-22)10-16(24)26-11-20/h13,15,17H,4-12H2,1-3H3 |
InChIKey |
YZHXQKBOFMZBLU-UHFFFAOYSA-N |
Molecular Weight |
406.475 g/mol |
SMILES |
C123C4(OC5(CC(=O)OC5)CC4)C(C)CC(C2C(C)(CCC1)C(OC3)=O)OC(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.85254 |