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Palominin
SpectraBase Compound ID BacamkOXyjc
InChI InChI=1S/C25H34O4/c1-18(8-5-9-19(2)11-7-13-22-14-15-28-17-22)10-6-12-20(3)16-23-24(26)21(4)25(27)29-23/h8,11-12,14-15,17,23,26H,5-7,9-10,13,16H2,1-4H3/b18-8+,19-11+,20-12+
InChIKey XLZQAXPNYWWSQS-UBBYFQHTSA-N
Mol Weight 398.5 g/mol
Molecular Formula C25H34O4
Exact Mass 398.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NMODBrBUf3
Name Palominin
Alternate Name(s) 5-[(2E,6E,10E)-13-(3-furyl)-2,6,10-trimethyl-2,6,10-tridecatrienyl]-4-hydroxy-3-methyl-2(5H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O4
InChI InChI=1S/C25H34O4/c1-18(8-5-9-19(2)11-7-13-22-14-15-28-17-22)10-6-12-20(3)16-23-24(26)21(4)25(27)29-23/h8,11-12,14-15,17,23,26H,5-7,9-10,13,16H2,1-4H3/b18-8+,19-11+,20-12+
InChIKey XLZQAXPNYWWSQS-UBBYFQHTSA-N
Molecular Weight 398.543 g/mol
SMILES OC1=C(C(OC1C\C(=C\CC\C(=C\CC\C(=C\CCc1cocc1)C)C)C)=O)C
SPLASH splash10-06zi-5900000000-bd0d2a0a291db17fc908
Source of Spectrum F-46-1123-1
Wiley ID 1368603