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1-[3,8-Dimethyl-5-(propan-2-yl)azulen-1-yl]-3-(4-methylphenyl)prop-2-yn-1-one
SpectraBase Compound ID KLcj6PaQz8n
InChI InChI=1S/C25H24O/c1-16(2)21-12-8-18(4)25-22(15-21)19(5)14-23(25)24(26)13-11-20-9-6-17(3)7-10-20/h6-10,12,14-16H,1-5H3
InChIKey UHIMLZQPQHHZTC-UHFFFAOYSA-N
Mol Weight 340.47 g/mol
Molecular Formula C25H24O
Exact Mass 340.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fiuv945KIIo
Name 1-[3,8-Dimethyl-5-(propan-2-yl)azulen-1-yl]-3-(4-methylphenyl)prop-2-yn-1-one
Appearance Brown solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24O
InChI InChI=1S/C25H24O/c1-16(2)21-12-8-18(4)25-22(15-21)19(5)14-23(25)24(26)13-11-20-9-6-17(3)7-10-20/h6-10,12,14-16H,1-5H3
InChIKey UHIMLZQPQHHZTC-UHFFFAOYSA-N
Instrument Name Finnigen MAT 200
Ionization Type EI+
Literature Reference DOI 10.3762/bjoc.7.136
Molecular Weight 340.466 g/mol
SMILES c12c(c(ccc(c2)C(C)C)C)c(cc1C)C(C#Cc1ccc(cc1)C)=O
SPLASH splash10-000f-2139000000-973a6e69683eac0e1d92
Source of Spectrum BJO-7-SM9-3d
Wiley ID 1867032