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3,3-Dimethyl-4-isopropenyl-spiro[thietan-2,9'-xanthen]
SpectraBase Compound ID JMCUJUqm9iw
InChI InChI=1S/C20H20OS/c1-13(2)18-19(3,4)20(22-18)14-9-5-7-11-16(14)21-17-12-8-6-10-15(17)20/h5-12,18H,1H2,2-4H3
InChIKey UFOSGWLKOUHYBH-UHFFFAOYSA-N
Mol Weight 308.44 g/mol
Molecular Formula C20H20OS
Exact Mass 308.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbuxyG8VkbP
Name 3,3-Dimethyl-4-isopropenyl-spiro[thietan-2,9'-xanthen]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20OS
InChI InChI=1S/C20H20OS/c1-13(2)18-19(3,4)20(22-18)14-9-5-7-11-16(14)21-17-12-8-6-10-15(17)20/h5-12,18H,1H2,2-4H3
InChIKey UFOSGWLKOUHYBH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19721050627
Molecular Weight 308.439 g/mol
SMILES c1cc2c(cc1)C1(c3c(O2)cccc3)C(C(S1)C(=C)C)(C)C
SPLASH splash10-03di-3090000000-c2c92c881a672851ab25
Source of Spectrum K-105-2020-10
Synonyms 3,3-Dimethyl-4-(prop-1-en-2-yl)spiro[thietane-2,9'-xanthene]
Wiley ID 1794729