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KNEGLOMERATANONE-B
SpectraBase Compound ID J5mVTxjRqO8
InChI InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-15-19(23)16-20(24)21(18)17(2)22/h15-16,23-24H,3-14H2,1-2H3
InChIKey LKFIFZHFSPDZEZ-UHFFFAOYSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ItNY6D6aCXk
Name 1-(2,4-dihydroxy-6-tridecyl-phenyl)ethanone
Alternate Name(s) 1-[2,4-bis(oxidanyl)-6-tridecyl-phenyl]ethanone Kneglomeratanone B
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-15-19(23)16-20(24)21(18)17(2)22/h15-16,23-24H,3-14H2,1-2H3
InChIKey LKFIFZHFSPDZEZ-UHFFFAOYSA-N
Molecular Weight 334.500 g/mol
SMILES Oc1cc(c(c(c1)O)C(=O)C)CCCCCCCCCCCCC
SPLASH splash10-066r-9802000000-00a88405662189c4beab
Source of Spectrum X2-57-380-3
Wiley ID 1605382