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3-Methyloctahydro-1H-cyclobuta[c]azulen-2(2aH)-one
SpectraBase Compound ID Lqkih61NBp5
InChI InChI=1S/C13H20O/c1-9-7-10-5-3-2-4-6-13(10)8-11(14)12(9)13/h9-10,12H,2-8H2,1H3
InChIKey ABRNENRZWLLUHE-UHFFFAOYSA-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 FCESY6sZw3a
Name 3-Methyloctahydro-1H-cyclobuta[c]azulen-2(2aH)-one
Alternate Name(s) 5-Methyltricyclo[5.5.0.0(1,4)]]dodecan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
InChI InChI=1S/C13H20O/c1-9-7-10-5-3-2-4-6-13(10)8-11(14)12(9)13/h9-10,12H,2-8H2,1H3
InChIKey ABRNENRZWLLUHE-UHFFFAOYSA-N
Molecular Weight 192.302 g/mol
SMILES C123C(C(C)CC3CCCCC1)C(C2)=O
SPLASH splash10-000l-6900000000-ea5ff71373309ef77b5b
Source of Spectrum F-51-3447-31
Wiley ID 791485