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4-keto-3a,5,6,6a-tetrahydro-3H-pentalene-1-carboxylic acid ethyl ester
SpectraBase Compound ID 1cFzWGCfyQe
InChI InChI=1S/C11H14O3/c1-2-14-11(13)9-4-3-8-7(9)5-6-10(8)12/h4,7-8H,2-3,5-6H2,1H3
InChIKey GBVIMEBTWGDTAL-UHFFFAOYSA-N
Mol Weight 194.23 g/mol
Molecular Formula C11H14O3
Exact Mass 194.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GL3weWwQDsc
Name 4-keto-3a,5,6,6a-tetrahydro-3H-pentalene-1-carboxylic acid ethyl ester
CAS Registry Number 122047-78-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O3
InChI InChI=1S/C11H14O3/c1-2-14-11(13)9-4-3-8-7(9)5-6-10(8)12/h4,7-8H,2-3,5-6H2,1H3
InChIKey GBVIMEBTWGDTAL-UHFFFAOYSA-N
Molecular Weight 194.230 g/mol
SMILES C=1(C2C(C(=O)CC2)CC1)C(=O)OCC
SPLASH splash10-00kf-5900000000-94b2badcf98ac693cda3
Source of Spectrum C-111-6704-1
Synonyms 4-Oxo-3a,5,6,6a-tetrahydro-3H-pentalene-1-carboxylic acid ethyl ester Ethyl 4-oxidanylidene-3a,5,6,6a-tetrahydro-3H-pentalene-1-carboxylate Ethyl 4-oxo-3,3a,4,5,6,6a-hexahydro-1-pentalenecarboxylate Ethyl 4-oxo-3a,5,6,6a-tetrahydro-3H-pentalene-1-carboxylate
Wiley ID 1190712