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(Z)-5-[(8-(3-HYDROXY-3-METHYL-1-BUTYNYL)-1-NAPHTHYL)-METHYLIDENE]-2,6-DIMETHYL-3-HEPTYNE-2,6-DIOL
SpectraBase Compound ID 3wBBokyJd2G
InChI InChI=1S/C25H28O3/c1-23(2,26)15-13-19-11-7-9-18-10-8-12-20(22(18)19)17-21(25(5,6)28)14-16-24(3,4)27/h7-12,17,26-28H,1-6H3/b21-17-
InChIKey GNRGSIXNYDKAIV-FXBPSFAMSA-N
Mol Weight 376.5 g/mol
Molecular Formula C25H28O3
Exact Mass 376.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AXjCXMSJXA
Name (5Z)-2,6-dimethyl-5-[[8-(3-methyl-3-oxidanyl-but-1-ynyl)naphthalen-1-yl]methylidene]hept-3-yne-2,6-diol
Comments Less than 3 mono-isotopic peaks
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Formula C25H28O3
InChI InChI=1S/C25H28O3/c1-23(2,26)15-13-19-11-7-9-18-10-8-12-20(22(18)19)17-21(25(5,6)28)14-16-24(3,4)27/h7-12,17,26-28H,1-6H3/b21-17-
InChIKey GNRGSIXNYDKAIV-FXBPSFAMSA-N
Molecular Weight 376.496 g/mol
SMILES OC(C#Cc1c2c(\C=C/(C(O)(C)C)C#CC(O)(C)C)cccc2ccc1)(C)C
SPLASH splash10-0a4i-9000000000-d96ff1618a220cac2682
Source of Spectrum J-63-2856-4
Synonyms (5Z)-5-[[8-(3-hydroxy-3-methyl-but-1-ynyl)-1-naphthyl]methylene]-2,6-dimethyl-hept-3-yne-2,6-diol (5Z)-5-[[8-(3-hydroxy-3-methylbut-1-ynyl)-1-naphthalenyl]methylidene]-2,6-dimethyl-3-heptyne-2,6-diol (5Z)-5-[[8-(3-hydroxy-3-methylbut-1-ynyl)naphthalen-1-yl]methylidene]-2,6-dimethylhept-3-yne-2,6-diol
Wiley ID 1358068