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3-Oxo-18-nor-abieta-8,11,13-triene

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3-Oxo-18-nor-abieta-8,11,13-triene
SpectraBase Compound ID 44KRxgPnNEx
InChI InChI=1S/C19H26O/c1-12(2)14-5-8-17-15(11-14)6-7-16-13(3)18(20)9-10-19(16,17)4/h5,8,11-13,16H,6-7,9-10H2,1-4H3/t13-,16+,19+/m1/s1
InChIKey PMZSHMPETRKMLW-AZOIQLNYSA-N
Mol Weight 270.42 g/mol
Molecular Formula C19H26O
Exact Mass 270.198365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDI5L3pl6ON
Name 3-oxo-18-nor-Abieta-8,11,13-triene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 270.198365456 u
Formula C19H26O
InChI InChI=1S/C19H26O/c1-12(2)14-5-8-17-15(11-14)6-7-16-13(3)18(20)9-10-19(16,17)4/h5,8,11-13,16H,6-7,9-10H2,1-4H3/t13-,16+,19+/m1/s1
InChIKey PMZSHMPETRKMLW-AZOIQLNYSA-N
Molecular Weight 270.416 g/mol
SMILES [C@@]12([C@]([C@](C)([H])C(CC2)=O)(CCC2=C1C=CC(C(C)C)=C2)[H])C