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5-Methyl-9.beta.-hydroxy-3-oxo-4,11-dioxatetracyclo[5.2.1.1(5,8).0(2,6)]undecane
SpectraBase Compound ID I1eJ3xve2ip
InChI InChI=1S/C10H12O4/c1-10-6-4-2-3(5(6)9(12)14-10)7(11)8(4)13-10/h3-8,11H,2H2,1H3/t3-,4+,5+,6-,7-,8+,10+/m0/s1
InChIKey PQCGHRDZQLBYSM-BEMWSYKUSA-N
Mol Weight 196.2 g/mol
Molecular Formula C10H12O4
Exact Mass 196.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dju4ByIBxKP
Name 5-Methyl-9.beta.-hydroxy-3-oxo-4,11-dioxatetracyclo[5.2.1.1(5,8).0(2,6)]undecane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O4
InChI InChI=1S/C10H12O4/c1-10-6-4-2-3(5(6)9(12)14-10)7(11)8(4)13-10/h3-8,11H,2H2,1H3/t3-,4+,5+,6-,7-,8+,10+/m0/s1
InChIKey PQCGHRDZQLBYSM-BEMWSYKUSA-N
Molecular Weight 196.202 g/mol
SMILES O[C@@]1([C@@]2(O[C@]3([C@@]4([C@@]([C@@]1(C[C@@]24[H])[H])(C(O3)=O)[H])[H])C)[H])[H]
SPLASH splash10-0002-9000000000-2ff52483613857252c7a
Source of Spectrum F-56-345-8
Synonyms (9S)-9-hydroxy-6-methyl-5,7-dioxatetracyclo[6.3.0.0(2,6).0(3,10)]undecan-4-one
Wiley ID 855592