| SpectraBase Spectrum ID |
2KYiYdoBXJi |
| Name |
Naphtho[2,3-D]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-[4-(phenylmethoxy)phenyl]-, (5.alpha.,6.beta.,7.alpha.)-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.188194694 u |
| Formula |
C26H26O3 |
| InChI |
InChI=1S/C26H26O3/c1-17-12-21-13-24-25(29-16-28-24)14-23(21)26(18(17)2)20-8-10-22(11-9-20)27-15-19-6-4-3-5-7-19/h3-11,13-14,17-18,26H,12,15-16H2,1-2H3/t17-,18+,26+/m0/s1 |
| InChIKey |
XDJCEFWRUCMHOW-CUAXAMRHSA-N |
| Molecular Weight |
386.491 g/mol |
| SMILES |
C12=C(C[C@@]([C@]([C@@]2(C=2C=CC(OCC=3C=CC=CC3)=CC2)[H])(C)[H])(C)[H])C=C2C(=C1)OCO2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.866731 |
![Naphtho[2,3-d]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-[4-(phenylmethoxy)phenyl]-, (5.alpha.,6.beta.,7.alpha.)-(.+-.)-](/api/spectrum/2KYiYdoBXJi/structure.png?h=300&w=458 "Naphtho[2,3-d]-1,3-dioxole, 5,6,7,8-tetrahydro-6,7-dimethyl-5-[4-(phenylmethoxy)phenyl]-, (5.alpha.,6.beta.,7.alpha.)-(.+-.)-")
