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2,7-Di-n-hexanoyl-9,9-dimethylxanthene
SpectraBase Compound ID KifI1kg5IbX
InChI InChI=1S/C27H34O3/c1-5-7-9-11-23(28)19-13-15-25-21(17-19)27(3,4)22-18-20(14-16-26(22)30-25)24(29)12-10-8-6-2/h13-18H,5-12H2,1-4H3
InChIKey CROKULOUEWZFNH-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C27H34O3
Exact Mass 406.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36ahoZD6TVS
Name 2,7-Di-n-hexanoyl-9,9-dimethylxanthene
Alternate Name(s) 1,1'-(9,9-dimethyl-9H-xanthene-2,7-diyl)bis(hexan-1-one)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O3
InChI InChI=1S/C27H34O3/c1-5-7-9-11-23(28)19-13-15-25-21(17-19)27(3,4)22-18-20(14-16-26(22)30-25)24(29)12-10-8-6-2/h13-18H,5-12H2,1-4H3
InChIKey CROKULOUEWZFNH-UHFFFAOYSA-N
Molecular Weight 406.566 g/mol
SMILES C1(c2cc(ccc2Oc2ccc(cc12)C(CCCCC)=O)C(CCCCC)=O)(C)C
SPLASH splash10-0006-0119000000-223a1133fe43d5357077
Source of Spectrum ASC-346-789/SM8-31
Wiley ID 1767627