| SpectraBase Spectrum ID |
3AdOwmDNa87 |
| Name |
6H-Benzo[C]cyclopropa[B]pyran-5(4ah)-one, 1,1A,7,8-tetrahydro-1A,3,6,6-tetramethyl-, (1A.alpha.,4A.beta.,8ar*)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.146329882 u |
| Formula |
C14H20O2 |
| InChI |
InChI=1S/C14H20O2/c1-9-7-10-11(15)12(2,3)5-6-14(10)8-13(14,4)16-9/h7,10H,5-6,8H2,1-4H3 |
| InChIKey |
LFXZCHSXSSMRTC-UHFFFAOYSA-N |
| Molecular Weight |
220.312 g/mol |
| SMILES |
C123C(OC(=CC3C(=O)C(CC1)(C)C)C)(C)C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893381 |
![6H-Benzo[c]cyclopropa[b]pyran-5(4aH)-one, 1,1a,7,8-tetrahydro-1a,3,6,6-tetramethyl-, (1a.alpha.,4a.beta.,8aR*)-](/api/spectrum/3AdOwmDNa87/structure.png?h=300&w=458 "6H-Benzo[c]cyclopropa[b]pyran-5(4aH)-one, 1,1a,7,8-tetrahydro-1a,3,6,6-tetramethyl-, (1a.alpha.,4a.beta.,8aR*)-")
