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1H-Inden-1-one, 2,3,3a,4,5,7a-hexahydro-3,3a,7,7a-tetramethyl-, (3.alpha.,3a.alpha.,7a.alpha.)-(.+-.)-
SpectraBase Compound ID LSNgIcdzDpG
InChI InChI=1S/C13H20O/c1-9-6-5-7-12(3)10(2)8-11(14)13(9,12)4/h6,10H,5,7-8H2,1-4H3/t10-,12+,13-/m0/s1
InChIKey MZVWPOBUTVRHOE-UHTWSYAYSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0dNEosOFvD
Name 1H-Inden-1-one, 2,3,3a,4,5,7a-hexahydro-3,3a,7,7a-tetramethyl-, (3.alpha.,3a.alpha.,7a.alpha.)-(.+-.)-
CAS Registry Number 121944-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-9-6-5-7-12(3)10(2)8-11(14)13(9,12)4/h6,10H,5,7-8H2,1-4H3/t10-,12+,13-/m0/s1
InChIKey MZVWPOBUTVRHOE-UHTWSYAYSA-N
Molecular Weight 192.302 g/mol
SMILES [C@@]12([C@@]([C@@](C)(CC2=O)[H])(CCC=C1C)C)C
SPLASH splash10-00di-0900000000-72a2bf3c1464a2dac4f7
Source of Spectrum F-44-4843-2
Synonyms (3S,3aR,7aR)-3,3a,7,7a-tetramethyl-2,3,3a,4,5,7a-hexahydro-1H-inden-1-one 3.beta.,3a.beta.,7,7a.beta.-tetramethyl-2,3,3a,4,5,7a-hexahydroinden-1-one
Wiley ID 1188971