| SpectraBase Spectrum ID |
EaUCCJUfWMc |
| Name |
Isobenzofuro[5,4-B]benzofuran-1,3-dione, 3A,4,10B,10C-tetrahydro-, (3A.alpha.,10B.alpha.,10C.alpha.)-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.057908798 u |
| Formula |
C14H10O4 |
| InChI |
InChI=1S/C14H10O4/c15-13-8-5-6-10-11(12(8)14(16)18-13)7-3-1-2-4-9(7)17-10/h1-4,6,8,11-12H,5H2/t8-,11+,12-/m1/s1 |
| InChIKey |
LVIVRRGGDNMIRJ-JFUSQASVSA-N |
| Molecular Weight |
242.230 g/mol |
| SMILES |
C1([C@]2([C@@]3(C(OC4=C3C=CC=C4)=CC[C@@]2([H])C(O1)=O)[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918289 |
![Isobenzofuro[5,4-b]benzofuran-1,3-dione, 3a,4,10b,10c-tetrahydro-, (3a.alpha.,10b.alpha.,10c.alpha.)-(.+-.)-](/api/spectrum/EaUCCJUfWMc/structure.png?h=300&w=458 "Isobenzofuro[5,4-b]benzofuran-1,3-dione, 3a,4,10b,10c-tetrahydro-, (3a.alpha.,10b.alpha.,10c.alpha.)-(.+-.)-")
