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1H-Inden-1-one, 3-[(acetyloxy)methylene]-2,3,4,5,6,7-hexahydro-, (E)-
SpectraBase Compound ID CHXxqVUoS76
InChI InChI=1S/C12H14O3/c1-8(13)15-7-9-6-12(14)11-5-3-2-4-10(9)11/h7H,2-6H2,1H3/b9-7+
InChIKey VKCQYVSQWLWTAB-VQHVLOKHSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Aa5otrvEZ36
Name 1H-Inden-1-one, 3-[(acetyloxy)methylene]-2,3,4,5,6,7-hexahydro-, (E)-
Alternate Name(s) (E)-(3-oxo-2,3,4,5,6,7-hexahydro-1H-inden-1-ylidene)methyl acetate (E)-3-Acetoxymethyliden-4,5,6,7-tetrahydro-1-indanone
CAS Registry Number 66415-25-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-8(13)15-7-9-6-12(14)11-5-3-2-4-10(9)11/h7H,2-6H2,1H3/b9-7+
InChIKey VKCQYVSQWLWTAB-VQHVLOKHSA-N
Molecular Weight 206.241 g/mol
SMILES C1=2\C(CC(C2CCCC1)=O)=C\OC(=O)C
SPLASH splash10-03di-2910000000-ee055b1bca29fec16182
Source of Spectrum H-61-276-0
Wiley ID 1204391