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(5S)-3-[(E)-7-Hydroxyhept-1-enyl]-2,5-dihydro-5-methylfuran-2-one
SpectraBase Compound ID 88NWr0EN6oT
InChI InChI=1S/C12H18O3/c1-10-9-11(12(14)15-10)7-5-3-2-4-6-8-13/h5,7,9-10,13H,2-4,6,8H2,1H3/b7-5+/t10-/m0/s1
InChIKey IUBJKWRPLDRUGI-STUBTGCMSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ygcyme7eSa
Name (5S)-3-[(E)-7-Hydroxyhept-1-enyl]-2,5-dihydro-5-methylfuran-2-one
Alternate Name(s) (5S)-3-[(1E)-7-hydroxy-1-heptenyl]-5-methyl-2(5H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-10-9-11(12(14)15-10)7-5-3-2-4-6-8-13/h5,7,9-10,13H,2-4,6,8H2,1H3/b7-5+/t10-/m0/s1
InChIKey IUBJKWRPLDRUGI-STUBTGCMSA-N
Molecular Weight 210.273 g/mol
SMILES OCCCCC\C=C\C=1C(O[C@@](C)(C1)[H])=O
SPLASH splash10-0006-9200000000-13283a511e63644740ac
Source of Spectrum SO-0-485-7
Wiley ID 875340