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1,17-Methanocyclooctadeca[c]furan-19,20(3H)-dione, 3a,4,5,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-18-hydroxy-3,3,6,1 0,14-pentamethyl-
SpectraBase Compound ID CjhSIaC31TG
InChI InChI=1S/C26H40O4/c1-16-8-6-10-17(2)12-14-19-22(27)24(29)21-20(15-13-18(3)11-7-9-16)26(4,5)30-25(21)23(19)28/h16-18,20,27H,6-15H2,1-5H3
InChIKey XBLYMIMQBVKMON-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C26H40O4
Exact Mass 416.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BeD3dj8VpR5
Name 1,17-Methanocyclooctadeca[c]furan-19,20(3H)-dione, 3a,4,5,6,7,8,9,10,11,12,13,14,15,16-tetradecahydro-18-hydroxy-3,3,6,1 0,14-pentamethyl-
CAS Registry Number 58262-73-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H40O4
InChI InChI=1S/C26H40O4/c1-16-8-6-10-17(2)12-14-19-22(27)24(29)21-20(15-13-18(3)11-7-9-16)26(4,5)30-25(21)23(19)28/h16-18,20,27H,6-15H2,1-5H3
InChIKey XBLYMIMQBVKMON-UHFFFAOYSA-N
Molecular Weight 416.602 g/mol
SMILES OC1=C2CCC(CCCC(CCCC(CCC3C(=C(C2=O)OC3(C)C)C1=O)C)C)C
SPLASH splash10-014i-0020900000-6a3443df21d2fc576fd9
Source of Spectrum O-11-474-1
Synonyms 19-hydroxy-3,3,7,11,15-pentamethyl-2-oxatricyclo[16.3.1.0(4,21)]docosa-1(21),18-diene-20,22-dione Hexahydrotridentoquinone
Wiley ID 1376543