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2-tert-Butyl-4a-methyltetrahydrocyclopenta[d][1,3]dioxin-4(4ah)-one
SpectraBase Compound ID InmBIh96zM1
InChI InChI=1S/C12H20O3/c1-11(2,3)10-14-8-6-5-7-12(8,4)9(13)15-10/h8,10H,5-7H2,1-4H3
InChIKey QQHGMGACVDPHLW-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0NI28crw9u
Name 2-tert-Butyl-4a-methyltetrahydrocyclopenta[d][1,3]dioxin-4(4ah)-one
CAS Registry Number 124898-89-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-11(2,3)10-14-8-6-5-7-12(8,4)9(13)15-10/h8,10H,5-7H2,1-4H3
InChIKey QQHGMGACVDPHLW-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES C12(C(CCC2)OC(OC1=O)C(C)(C)C)C
SPLASH splash10-00lr-9000000000-219fa8a19498571ce35d
Synonyms 2,4-Dioxabicyclo[4.3.0]nonan-5-one, 2-t-butyl-5-methyl- (1R,3S,6S)- 2-tert-Butyl-4a-methyl-5,6,7,7a-tetrahydrocyclopenta[d][1,3]dioxin-4-one
Wiley ID 1479657