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3a,7a-Propano-1H-inden-1-one, hexahydro-
SpectraBase Compound ID 4WRwChS6sCF
InChI InChI=1S/C12H18O/c13-10-4-9-11-5-1-2-7-12(10,11)8-3-6-11/h1-9H2/t11-,12+/m1/s1
InChIKey RCMHMMFHMZTDPB-NEPJUHHUSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6gqcAUwqiFa
Name 3a,7a-Propano-1H-inden-1-one, hexahydro-
Alternate Name(s) Tricyclo[4.3.3.0(1,6)]dodecan-7-one [4.3.3]propellanone
CAS Registry Number 38312-62-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c13-10-4-9-11-5-1-2-7-12(10,11)8-3-6-11/h1-9H2/t11-,12+/m1/s1
InChIKey RCMHMMFHMZTDPB-NEPJUHHUSA-N
Molecular Weight 178.275 g/mol
SMILES [C@@]123[C@@](CCC3=O)(CCC1)CCCC2
SPLASH splash10-00fr-1900000000-6e0ed7305f85217d2188
Source of Spectrum J-49-663-0
Wiley ID 1174646