Debug Info

object
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_id
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YWD28y0D3v
spectrumID
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YWD28y0D3v
cost
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specType
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262144
xnmrNucleus
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WRX:17975:1
hasStructureAssignments
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properties
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
isFullSpectrum
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compound
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1735074081058
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3-METHYLBICYCLO-[2.2.1]-HEPTA-2,5-DIEN-2-CARBONSAEURE
SpectraBase Compound ID KhRIt16raNX
InChI InChI=1S/C9H10O2/c1-5-6-2-3-7(4-6)8(5)9(10)11/h2-3,6-7H,4H2,1H3,(H,10,11)/t6-,7+/m1/s1
InChIKey ACSFOUMJIUHTCO-RQJHMYQMSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID YWD28y0D3v
Name 3-METHYLBICYCLO-[2.2.1]-HEPTA-2,5-DIEN-2-CARBONSAEURE
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-5-6-2-3-7(4-6)8(5)9(10)11/h2-3,6-7H,4H2,1H3,(H,10,11)/t6-,7+/m1/s1
InChIKey ACSFOUMJIUHTCO-RQJHMYQMSA-N
Literature Reference Author F.M.SIMMROSS,P.WEYERSTAHL
Literature Reference Citation LIEB.ANN.CHEM.,1089(1981)
Molecular Weight 150.177 g/mol
Solvent CDCl3
Source File Reference UNIW1657
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