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3-cyclohexyl-3-hydroxy-tetralin-1,2,4-trione

View entire compound with spectra: 1 MS (GC)

3-cyclohexyl-3-hydroxy-tetralin-1,2,4-trione
SpectraBase Compound ID HvsaVDNPmW2
InChI InChI=1S/C16H16O4/c17-13-11-8-4-5-9-12(11)14(18)16(20,15(13)19)10-6-2-1-3-7-10/h4-5,8-10,20H,1-3,6-7H2
InChIKey JLPWXRQMDZDNHP-UHFFFAOYSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FP9DSSERww6
Name 3-cyclohexyl-3-hydroxy-tetralin-1,2,4-trione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O4
InChI InChI=1S/C16H16O4/c17-13-11-8-4-5-9-12(11)14(18)16(20,15(13)19)10-6-2-1-3-7-10/h4-5,8-10,20H,1-3,6-7H2
InChIKey JLPWXRQMDZDNHP-UHFFFAOYSA-N
Molecular Weight 272.300 g/mol
SMILES OC1(C(C(c2c(C1=O)cccc2)=O)=O)C1CCCCC1
SPLASH splash10-01q9-5900000000-c311c9fd494c510d659f
Source of Spectrum J-64-7336-5
Synonyms 3-cyclohexyl-3-hydroxynaphthalene-1,2,4-trione 3-cyclohexyl-3-oxidanyl-naphthalene-1,2,4-trione
Wiley ID 1531145