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IWZXZFNLDPFUKQ-NAJRYUOPSA-N
SpectraBase Compound ID 5tPIib237EO
InChI InChI=1S/C12H20O3/c1-2-6-11-9-10(13)7-4-3-5-8-12(14)15-11/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3/b7-4+/t10-,11+/m0/s1
InChIKey IWZXZFNLDPFUKQ-NAJRYUOPSA-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 DRzG0J9hYJX
Name (2R,4R,5E)-4-hydroxy-2-propyl-2,3,4,7,8,9-hexahydrooxecin-10-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-2-6-11-9-10(13)7-4-3-5-8-12(14)15-11/h4,7,10-11,13H,2-3,5-6,8-9H2,1H3/b7-4+/t10-,11+/m0/s1
InChIKey IWZXZFNLDPFUKQ-NAJRYUOPSA-N
Molecular Weight 212.289 g/mol
SMILES O[C@]1(\C=C\CCCC(O[C@@](C1)(CCC)[H])=O)[H]
SPLASH splash10-0lxy-9800000000-071ad21abff1b7548b34
Source of Spectrum QC-17-329-1
Synonyms (2R,4R,5E)-4-oxidanyl-2-propyl-2,3,4,7,8,9-hexahydrooxecin-10-one
Wiley ID 1638079