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1,1,3a-Trimethyl-1a,3a,5,6-tetrahydrocyclopropa[c]pentalen-4(1H)-one
SpectraBase Compound ID 6fIdbVcoZi3
InChI InChI=1S/C12H16O/c1-10(2)8-4-6-11(3)9(13)5-7-12(8,10)11/h4,6,8H,5,7H2,1-3H3
InChIKey KWFCZMCFCFEYOP-UHFFFAOYSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SKKXLd497Y
Name 1,1,3a-Trimethyl-1a,3a,5,6-tetrahydrocyclopropa[c]pentalen-4(1H)-one
Alternate Name(s) 1,1,3a-Trimethyl-1a,3a,5,6-tetrahydro-1H-cyclopropa[c]pentalen-4-one
CAS Registry Number 91531-54-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-10(2)8-4-6-11(3)9(13)5-7-12(8,10)11/h4,6,8H,5,7H2,1-3H3
InChIKey KWFCZMCFCFEYOP-UHFFFAOYSA-N
Molecular Weight 176.259 g/mol
SMILES CC1(C23C(C=CC13)(C(CC2)=O)C)C
SPLASH splash10-05uu-6900000000-c87eee8cd2fcda505227
Wiley ID 1489938