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1,4-PENTALENEDIOL, OCTAHYDRO-, DIACETATE, (1alpha,3Aalpha,4alpha,6Aalpha)-
SpectraBase Compound ID IhBuhU0JDUT
InChI InChI=1S/C12H18O4/c1-7(13)15-11-5-3-10-9(11)4-6-12(10)16-8(2)14/h9-12H,3-6H2,1-2H3
InChIKey HYVIARUUVHVLHF-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ddl0pEg3o4
Name 4-(Acetyloxy)octahydro-1-pentalenyl acetate
CAS Registry Number 17572-85-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-7(13)15-11-5-3-10-9(11)4-6-12(10)16-8(2)14/h9-12H,3-6H2,1-2H3
InChIKey HYVIARUUVHVLHF-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C(=O)(OC1CCC2C(CCC12)OC(=O)C)C
SPLASH splash10-0a4l-9400000000-ce36b2dbbd6ff211e221
Synonyms (4-acetoxy-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl) acetate (4-acetyloxy-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl) acetate (4-acetyloxy-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl) ethanoate 1,4-Pentalenediol, octahydro-, diacetate, (1.alpha.,3a.alpha.,4.alpha.,6a.alpha.)- Acetic acid (4-acetoxy-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl) ester Acetic acid (4-acetyloxy-1,2,3,3a,4,5,6,6a-octahydropentalen-1-yl) ester
Wiley ID 1485616