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1H-Cyclobuta[c]pentalen-5-one,2,2a,4a,5,6,7-hexahydro-2,2,4a-trimethyl
SpectraBase Compound ID A49jzX48Xjr
InChI InChI=1S/C13H18O/c1-11(2)8-13-7-5-10(14)12(13,3)6-4-9(11)13/h4,6,9H,5,7-8H2,1-3H3
InChIKey MUQXDWWTJHUXAX-UHFFFAOYSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GH9k0IAFY95
Name 1H-Cyclobuta[c]pentalen-5-one,2,2a,4a,5,6,7-hexahydro-2,2,4a-trimethyl
CAS Registry Number 81532-22-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-11(2)8-13-7-5-10(14)12(13,3)6-4-9(11)13/h4,6,9H,5,7-8H2,1-3H3
InChIKey MUQXDWWTJHUXAX-UHFFFAOYSA-N
Molecular Weight 190.286 g/mol
SMILES C123C(C=CC3C(C1)(C)C)(C(=O)CC2)C
SPLASH splash10-0006-9300000000-df088d479fa82d3ac581
Source of Spectrum H-64-2596-0
Synonyms 2,2,4a-Trimethyl-1,2,2a,4a,6,7-hexahydro-5H-cyclobuta[c]pentalen-5-one
Wiley ID 1186989