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

*Links on SpectraBase are not permalinks.
2,9,16,25-Tetraoxatricyclo[25.3.1.110,14]dotriaconta-1(31),10,12,14(32),27,29-hexaene-4,6-diyne-15,26-dione, 13,28-dihydroxy-
SpectraBase Compound ID 7M9a0jNLmz1
InChI InChI=1S/C28H28O8/c29-25-13-11-21-19-23(25)27(31)35-17-9-3-1-2-4-10-18-36-28(32)24-20-22(12-14-26(24)30)34-16-8-6-5-7-15-33-21/h11-14,19-20,29-30H,1-4,9-10,15-18H2
InChIKey DOPQMWGAEDPKQY-UHFFFAOYSA-N
Mol Weight 492.52 g/mol
Molecular Formula C28H28O8
Exact Mass 492.178418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID F8BhOsKa4ly
Name 2,9,16,25-Tetraoxatricyclo[25.3.1.110,14]dotriaconta-1(31),10,12,14(32),27,29-hexaene-4,6-diyne-15,26-dione, 13,28-dihydroxy-
Alternate Name(s) 13,28-dihydroxy-2,9,16,25-tetraoxatricyclo[25.3.1.1(10,14)]dotriaconta-1(31),10(32),11,13,27,29-hexaene-4,6-diyne-15,26-dione 2,11,19,26-Tetraoxa-1,12-dioxo[12.8]metacyclopha-21,23diyne-14,30-diol
CAS Registry Number 120296-77-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H28O8
InChI InChI=1S/C28H28O8/c29-25-13-11-21-19-23(25)27(31)35-17-9-3-1-2-4-10-18-36-28(32)24-20-22(12-14-26(24)30)34-16-8-6-5-7-15-33-21/h11-14,19-20,29-30H,1-4,9-10,15-18H2
InChIKey DOPQMWGAEDPKQY-UHFFFAOYSA-N
Molecular Weight 492.524 g/mol
SMILES Oc1c2C(OCCCCCCCCOC(c3cc(ccc3O)OCC#CC#CCOc(cc1)c2)=O)=O
SPLASH splash10-0f79-0920000000-845a1eb6272456cc3f85
Source of Spectrum C-111-3648-9
Wiley ID 1397576