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RHIZOPOGONE_
SpectraBase Compound ID GuJr1oIyR3l
InChI InChI=1S/C26H34O4/c1-16(2)14-20-15-19(5)11-7-9-17(3)8-6-10-18(4)12-13-21-23(27)25(29)22(20)26(30)24(21)28/h8,11-12,14,20,27,30H,6-7,9-10,13,15H2,1-5H3/b17-8+,18-12+,19-11+/t20-/m1/s1
InChIKey KKLNZLFIECUADF-UYSOGGTPSA-N
Mol Weight 410.6 g/mol
Molecular Formula C26H34O4
Exact Mass 410.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6imWJW6CBcQ
Name Rhizopogone
Appearance Red solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34O4
InChI InChI=1S/C26H34O4/c1-16(2)14-20-15-19(5)11-7-9-17(3)8-6-10-18(4)12-13-21-23(27)25(29)22(20)26(30)24(21)28/h8,11-12,14,20,27,30H,6-7,9-10,13,15H2,1-5H3/b17-8+,18-12+,19-11+/t20-/m1/s1
InChIKey KKLNZLFIECUADF-UYSOGGTPSA-N
Instrument Name Finnigan MAT 90 or Finnigan MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1021/np8007073
Molecular Weight 410.554 g/mol
Optical Rotation [a]D20 = +28 (c = 0.155, CHCl3)
Reported Formula C26H34O4
SMILES OC1=C2C(C(=C(C1=O)C\C=C/(C)CC\C=C\(CC\C=C\(C[C@]2(C=C(C)C)[H])C)C)O)=O
SPLASH splash10-00di-1391100000-27117c495aad5181f9c1
Source of Spectrum G4-72-SM3-1
Thin-Layer Chromatography Rf = 0.78 (0.2% aqueous NH4OH/MeCN, 9:1)
Wiley ID 1872152