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7-tert-Butoxy-9-hydroxy-6-methylbicyclo[4.3.0]non-1-en-3-one isomer
SpectraBase Compound ID 6Mjmx3IQpph
InChI InChI=1S/C14H22O3/c1-13(2,3)17-12-8-11(16)10-7-9(15)5-6-14(10,12)4/h7,11-12,16H,5-6,8H2,1-4H3/t11-,12-,14-/m0/s1
InChIKey MDWMQURGUPPALB-OBJOEFQTSA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eCMmm9aE2A
Name 7-tert-Butoxy-9-hydroxy-6-methylbicyclo[4.3.0]non-1-en-3-one isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-13(2,3)17-12-8-11(16)10-7-9(15)5-6-14(10,12)4/h7,11-12,16H,5-6,8H2,1-4H3/t11-,12-,14-/m0/s1
InChIKey MDWMQURGUPPALB-OBJOEFQTSA-N
Molecular Weight 238.327 g/mol
SMILES O[C@@]1(C=2[C@@]([C@@](OC(C)(C)C)(C1)[H])(CCC(C2)=O)C)[H]
SPLASH splash10-053u-4900000000-7351ec7f707b7e6ad728
Source of Spectrum F-50-8415-60
Synonyms (1S,3S,7aS)-1-tert-Butoxy-3-hydroxy-7a-methyl-1,2,3,6,7,7a-hexahydro-inden-5-one 1-tert-Butoxy-3-hydroxy-7a-methyl-1,2,3,6,7,7a-hexahydro-5H-inden-5-one 7-tert-Butoxy-9-hydroxy-6-methylbicyclo[4.3.0]non-1-en-3-one 7-tert-Butyloxy-9-hydroxy-6-methylbicyclo[4.3.0]non-1-en-3-one 7-tert-Butyloxy-9-hydroxy-6-methylbicyclo[4.3.0]non-1-en-3-one isomer
Wiley ID 1240909