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8,10-Dioxabicyclo[5.2.1]dec-3-ene-7-acetic acid, ethyl ester, (1S)-
SpectraBase Compound ID EGqXSqkA1TW
InChI InChI=1S/C12H18O4/c1-2-14-11(13)8-12-7-5-3-4-6-10(16-12)9-15-12/h3-4,10H,2,5-9H2,1H3/b4-3-/t10-,12?/m0/s1
InChIKey PTHNBCGWBAUXPN-CHDXLFJUSA-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 9xQAJaKaSJ
Name 8,10-Dioxabicyclo[5.2.1]dec-3-ene-7-acetic acid, ethyl ester, (1S)-
CAS Registry Number 123151-89-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-2-14-11(13)8-12-7-5-3-4-6-10(16-12)9-15-12/h3-4,10H,2,5-9H2,1H3/b4-3-/t10-,12?/m0/s1
InChIKey PTHNBCGWBAUXPN-CHDXLFJUSA-N
Molecular Weight 226.272 g/mol
SMILES C12(CC(=O)OCC)O[C@](C\C=C/CC2)([H])CO1
SPLASH splash10-000l-9600000000-1e6841a735a484ef6ee2
Source of Spectrum J-54-5161-39
Synonyms Ethyl (1S)-8,10-dioxabicyclo[5.2.1]dec-3-en-7-ylacetate Ethyl[(1S,7S)-8,10-dioxabicyclo[5.2.1]-3-decane-7-yl]acetate
Wiley ID 1227315