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5-Hydroxy-4-(3-methylfuryl)hept-4-en-3-one
SpectraBase Compound ID GGgBvtbpKr9
InChI InChI=1S/C12H16O3/c1-4-9(13)11(10(14)5-2)12-8(3)6-7-15-12/h6-7,13H,4-5H2,1-3H3/b11-9+
InChIKey NNQCPSWIAIBDCD-PKNBQFBNSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2MRS2ZFHwlS
Name 5-Hydroxy-4-(3-methylfuryl)hept-4-en-3-one
CAS Registry Number 122602-59-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-4-9(13)11(10(14)5-2)12-8(3)6-7-15-12/h6-7,13H,4-5H2,1-3H3/b11-9+
InChIKey NNQCPSWIAIBDCD-PKNBQFBNSA-N
Molecular Weight 208.257 g/mol
SMILES O\C(=C\(c1c(cco1)C)C(=O)CC)CC
SPLASH splash10-0a59-0960000000-4ea623226b9a9c88740d
Source of Spectrum KC-1988-1377-24
Synonyms (4Z)-5-hydroxy-4-(3-methyl-2-furyl)-4-hepten-3-one
Wiley ID 1206925