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3.beta.,3a.beta.,6a.beta.-Nepetolactone
SpectraBase Compound ID 8UoPhQlXmUy
InChI InChI=1S/C9H14O2/c1-5-3-4-7-6(2)11-9(10)8(5)7/h5-8H,3-4H2,1-2H3
InChIKey BVOMHKKJGKZXNL-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LRhwevpLMWN
Name 3.beta.,3a.beta.,6a.beta.-Nepetolactone
CAS Registry Number 58845-57-1
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-5-3-4-7-6(2)11-9(10)8(5)7/h5-8H,3-4H2,1-2H3
InChIKey BVOMHKKJGKZXNL-UHFFFAOYSA-N
Instrument Name SF = 100 MHz
Literature Reference J. Org. Chem. 45, 3811 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3