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(1RS,2SR)-Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate
SpectraBase Compound ID 9FFKwNmpfN0
InChI InChI=1S/C14H20O3/c1-13(2)6-9-5-11(15)14(3,10(9)7-13)8-12(16)17-4/h5,10H,6-8H2,1-4H3/t10-,14+/m1/s1
InChIKey FJEGGYQLFLWLMM-YGRLFVJLSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 20XpdboXzsV
Name (1RS,2SR)-Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-13(2)6-9-5-11(15)14(3,10(9)7-13)8-12(16)17-4/h5,10H,6-8H2,1-4H3/t10-,14+/m1/s1
InChIKey FJEGGYQLFLWLMM-YGRLFVJLSA-N
Molecular Weight 236.311 g/mol
SMILES C1=2[C@]([C@@](CC(=O)OC)(C)C(C2)=O)(CC(C1)(C)C)[H]
SPLASH splash10-056u-9810000000-317ccb4454ac075016c5
Source of Spectrum F-50-420-2
Synonyms Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate isomer ((1S,6aR)-1,5,5-Trimethyl-2-oxo-1,2,4,5,6,6a-hexahydro-pentalen-1-yl)-acetic acid methyl ester Methyl (1,5,5-trimethyl-2-oxo-1,2,4,5,6,6a-hexahydro-1-pentalenyl)acetate 2-[(1S,6aR)-1,5,5-trimethyl-2-oxo-6,6a-dihydro-4H-pentalen-1-yl]acetic acid methyl ester Methyl 2-[(1S,6aR)-1,5,5-trimethyl-2-oxo-6,6a-dihydro-4H-pentalen-1-yl]acetate Methyl 2-[(1S,6aR)-1,5,5-trimethyl-2-oxidanylidene-6,6a-dihydro-4H-pentalen-1-yl]ethanoate
Wiley ID 1238468