| SpectraBase Spectrum ID |
57K9qw9GSP0 |
| Name |
Dispiro[cyclohexane-1,2'-(4'-methyl-5'-phenyltetrahydrofuro[2,3-B]pyran-3'-one)-6',1''-cyclohexane] |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.219494823 u |
| Formula |
C24H30O3 |
| InChI |
InChI=1S/C24H30O3/c1-17-19-21(25)24(15-9-4-10-16-24)27-22(19)26-23(13-7-3-8-14-23)20(17)18-11-5-2-6-12-18/h2,5-6,11-12,17,20H,3-4,7-10,13-16H2,1H3/t17-,20?/m1/s1 |
| InChIKey |
LVHXSSXQFJYRRG-DIAVIDTQSA-N |
| Molecular Weight |
366.501 g/mol |
| SMILES |
C12=C(OC3(C([C@@]2(C)[H])C2=CC=CC=C2)CCCCC3)OC2(C1=O)CCCCC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.832486 |
![Dispiro[cyclohexane-1,2'-(4'-methyl-5'-phenyltetrahydrofuro[2,3-B]pyran-3'-one)-6',1''-cyclohexane]](/api/spectrum/57K9qw9GSP0/structure.png?h=300&w=458 "Dispiro[cyclohexane-1,2'-(4'-methyl-5'-phenyltetrahydrofuro[2,3-B]pyran-3'-one)-6',1''-cyclohexane]")
