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trans-3-Acetyl-4,4,5-trimethyl-5-isopropyldihydro-2(3H)-furanone
SpectraBase Compound ID 7of84GWk1fq
InChI InChI=1S/C12H20O3/c1-7(2)12(6)11(4,5)9(8(3)13)10(14)15-12/h7,9H,1-6H3/t9-,12+/m0/s1
InChIKey QSAMAKIVJHAERU-JOYOIKCWSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZYG3o73EVS
Name trans-3-Acetyl-4,4,5-trimethyl-5-isopropyldihydro-2(3H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-7(2)12(6)11(4,5)9(8(3)13)10(14)15-12/h7,9H,1-6H3/t9-,12+/m0/s1
InChIKey QSAMAKIVJHAERU-JOYOIKCWSA-N
Molecular Weight 212.289 g/mol
SMILES C1([C@](OC([C@@]1(C(=O)C)[H])=O)(C(C)C)C)(C)C
SPLASH splash10-001i-9100000000-4b82fcddf68b51dc2afb
Source of Spectrum C-115-962-5
Synonyms (3S,5R)-3-acetyl-5-isopropyl-4,4,5-trimethyldihydro-2(3H)-furanone
Wiley ID 1211590