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(1'RS,2SR)-2,6,6-trimethyl-2[1'(3-furyl)-2-oxopropyl]cyclohexanone
SpectraBase Compound ID JYPoE7KcTVh
InChI InChI=1S/C16H22O3/c1-11(17)13(12-6-9-19-10-12)16(4)8-5-7-15(2,3)14(16)18/h6,9-10,13H,5,7-8H2,1-4H3
InChIKey BXBNJYUJRBNZRR-UHFFFAOYSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rZE362VGNl
Name (1'RS,2SR)-2,6,6-trimethyl-2[1'(3-furyl)-2-oxopropyl]cyclohexanone
CAS Registry Number 124070-94-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O3
InChI InChI=1S/C16H22O3/c1-11(17)13(12-6-9-19-10-12)16(4)8-5-7-15(2,3)14(16)18/h6,9-10,13H,5,7-8H2,1-4H3
InChIKey BXBNJYUJRBNZRR-UHFFFAOYSA-N
Molecular Weight 262.349 g/mol
SMILES C1(C(C(CCC1)(C)C)=O)(C(c1cocc1)C(=O)C)C
SPLASH splash10-0aos-9610000000-3bb5546dcaeee23f12dc
Source of Spectrum J-55-1353-7
Synonyms 2-[1-(3-furyl)-2-oxopropyl]-2,6,6-trimethylcyclohexanone 2-[1-(3-furanyl)-2-oxopropyl]-2,6,6-trimethyl-1-cyclohexanone 2-[1-(furan-3-yl)-2-oxopropyl]-2,6,6-trimethylcyclohexan-1-one 2-[1-(3-furyl)-2-oxo-propyl]-2,6,6-trimethyl-cyclohexanone 2-[1-(furan-3-yl)-2-oxidanylidene-propyl]-2,6,6-trimethyl-cyclohexan-1-one
Wiley ID 1266147