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trans-Carbomethoxy-manool derivative
SpectraBase Compound ID 77ikL0Fg76h
InChI InChI=1S/C21H34O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,17-18H,2,7-13H2,1,3-6H3/b15-14+
InChIKey KYTKOCVFNCZSSC-CCEZHUSRSA-N
Mol Weight 318.5 g/mol
Molecular Formula C21H34O2
Exact Mass 318.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F67ma1DNvmI
Name
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Formula C21H34O2
InChI InChI=1S/C21H34O2/c1-15(14-19(22)23-6)8-10-17-16(2)9-11-18-20(3,4)12-7-13-21(17,18)5/h14,17-18H,2,7-13H2,1,3-6H3/b15-14+
InChIKey KYTKOCVFNCZSSC-CCEZHUSRSA-N
Molecular Weight 318.2550
SMILES CC1(C2CCC(=C)C(CC\C(=C\C(OC)=O)C)C2(C)CCC1)C
SPLASH splash10-0cem-7920000000-384b61b7d9de8115b888
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany