For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Dihydro-clusin - diacetate

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Dihydro-clusin - diacetate
SpectraBase Compound ID EG2XcgREGyI
InChI InChI=1S/C26H32O9/c1-16(27)32-13-20(8-18-6-7-22-23(10-18)35-15-34-22)21(14-33-17(2)28)9-19-11-24(29-3)26(31-5)25(12-19)30-4/h6-7,10-12,20-21H,8-9,13-15H2,1-5H3/t20-,21-/m0/s1
InChIKey PGLVKIQODAEYPR-SFTDATJTSA-N
Mol Weight 488.5 g/mol
Molecular Formula C26H32O9
Exact Mass 488.204633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DwNlwl3aQjm
Name Dihydro-clusin - diacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 488.204632601 u
Formula C26H32O9
InChI InChI=1S/C26H32O9/c1-16(27)32-13-20(8-18-6-7-22-23(10-18)35-15-34-22)21(14-33-17(2)28)9-19-11-24(29-3)26(31-5)25(12-19)30-4/h6-7,10-12,20-21H,8-9,13-15H2,1-5H3/t20-,21-/m0/s1
InChIKey PGLVKIQODAEYPR-SFTDATJTSA-N
Molecular Weight 488.533 g/mol
SMILES C1(=C(C=C(C=C1OC)C[C@]([C@@](CC1=CC=2OCOC2C=C1)(COC(=O)C)[H])(COC(=O)C)[H])OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.914686