| SpectraBase Spectrum ID |
FDa132i02Nc |
| Name |
(9S,10S)-10-(Benzyloxymethyl)-2,3,5,9-tetramethyl-11,12-dioxatricyclo[7.2.1.0(1,6)]dodeca-2,5-dien-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.183109313 u |
| Formula |
C22H26O4 |
| InChI |
InChI=1S/C22H26O4/c1-14-16(3)22-18(15(2)20(14)23)10-11-21(4,26-22)19(25-22)13-24-12-17-8-6-5-7-9-17/h5-9,19H,10-13H2,1-4H3/t19-,21-,22?/m0/s1 |
| InChIKey |
JPMJMZTUGJMJIC-QUCQDJGISA-N |
| Molecular Weight |
354.446 g/mol |
| SMILES |
C123C(=C(C)C(C(=C3C)C)=O)CC[C@@](O1)(C)[C@@](O2)(COCC=1C=CC=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.822927 |
![(9S,10S)-10-(Benzyloxymethyl)-2,3,5,9-tetramethyl-11,12-dioxatricyclo[7.2.1.0(1,6)]dodeca-2,5-dien-4-one](/api/spectrum/FDa132i02Nc/structure.png?h=300&w=458 "(9S,10S)-10-(Benzyloxymethyl)-2,3,5,9-tetramethyl-11,12-dioxatricyclo[7.2.1.0(1,6)]dodeca-2,5-dien-4-one")
