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3-[2-(2,6,6-Trimethylcyclohexenyl)ethyl]isoxazole-5(4H)-one
SpectraBase Compound ID Eha3qdQpNdk
InChI InChI=1S/C14H21NO2/c1-10-5-4-8-14(2,3)12(10)7-6-11-9-13(16)17-15-11/h4-9H2,1-3H3
InChIKey JVHSPJSHMMMAPF-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PD8X5AtJzL
Name 3-[2-(2,6,6-Trimethylcyclohexenyl)ethyl]isoxazole-5(4H)-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-10-5-4-8-14(2,3)12(10)7-6-11-9-13(16)17-15-11/h4-9H2,1-3H3
InChIKey JVHSPJSHMMMAPF-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES C1(=C(CCCC1(C)C)C)CCC1=NOC(C1)=O
SPLASH splash10-00ec-6900000000-ff1481218e3a70660cc3
Source of Spectrum AT-34-4792-9
Synonyms 3-[2-(2,6,6-trimethyl-1-cyclohexen-1-yl)ethyl]-5(4H)-isoxazolone 3-[2-(2,6,6-Trimethylcyclohexenyl)ethyl]oxazole-5(4H)-one
Wiley ID 852581