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9-[2-(Hydroxymethyl)cyclopropyl]-1-oxacyclonon-6-en-2-one
SpectraBase Compound ID 8SruHMy8t2E
InChI InChI=1S/C12H18O3/c13-8-9-7-10(9)11-5-3-1-2-4-6-12(14)15-11/h1,3,9-11,13H,2,4-8H2/b3-1-/t9-,10+,11-/m0/s1
InChIKey VFYHFEJYVPBMEI-IGQKVBKWSA-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 EBtvPRlCmhG
Name 9-[2-(Hydroxymethyl)cyclopropyl]-1-oxacyclonon-6-en-2-one
Alternate Name(s) (Z)-(S)-9-((2R,3R)-2-Hydroxymethyl-cyclopropyl)-4,5,8,9-tetrahydro-3H-oxonin-2-one (2S,4Z)-2-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]-3,6,7,8-tetrahydro-2H-oxonin-9-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c13-8-9-7-10(9)11-5-3-1-2-4-6-12(14)15-11/h1,3,9-11,13H,2,4-8H2/b3-1-/t9-,10+,11-/m0/s1
InChIKey VFYHFEJYVPBMEI-IGQKVBKWSA-N
Molecular Weight 210.273 g/mol
SMILES OC[C@]1([C@@](C1)([C@]1(OC(=O)CCC\C=C/C1)[H])[H])[H]
SPLASH splash10-03e9-7900000000-d17f29ec4ab4d3983363
Source of Spectrum J-62-6651-36
Wiley ID 1284884