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Trans-pinocarvyl laureate
SpectraBase Compound ID DzJ4EWLP4eo
InChI InChI=1S/C22H38O2/c1-5-6-7-8-9-10-11-12-13-14-21(23)24-20-16-18-15-19(17(20)2)22(18,3)4/h18-20H,2,5-16H2,1,3-4H3
InChIKey BQJZDGHPWPPVLY-UHFFFAOYSA-N
Mol Weight 334.5 g/mol
Molecular Formula C22H38O2
Exact Mass 334.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3iqgINafD30
Name Trans-pinocarvyl laureate
Comments Computed using HOSE algorithm
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Exact Mass 334.287180462 u
Formula C22H38O2
InChI InChI=1S/C22H38O2/c1-5-6-7-8-9-10-11-12-13-14-21(23)24-20-16-18-15-19(17(20)2)22(18,3)4/h18-20H,2,5-16H2,1,3-4H3
InChIKey BQJZDGHPWPPVLY-UHFFFAOYSA-N
Molecular Weight 334.544 g/mol
SMILES C(CCCCCCCCCCC)(=O)OC1C(C2C(C(C1)C2)(C)C)=C