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1,3-Benzenediol, o-cyclopropanecarbonyl-o'-valeryl-
SpectraBase Compound ID 9eVedTaZBvm
InChI InChI=1S/C15H18O4/c1-2-3-7-14(16)18-12-5-4-6-13(10-12)19-15(17)11-8-9-11/h4-6,10-11H,2-3,7-9H2,1H3
InChIKey PTVMXYURVTYAMU-UHFFFAOYSA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9S8YVcd2GLJ
Name 1,3-Benzenediol, o-cyclopropanecarbonyl-o'-valeryl-
Comments Computed using HOSE algorithm
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Exact Mass 262.120509056 u
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-2-3-7-14(16)18-12-5-4-6-13(10-12)19-15(17)11-8-9-11/h4-6,10-11H,2-3,7-9H2,1H3
InChIKey PTVMXYURVTYAMU-UHFFFAOYSA-N
Molecular Weight 262.305 g/mol
SMILES C1=C(C=C(C=C1)OC(=O)C1CC1)OC(=O)CCCC