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(1S,2R,3E,7E,11E)-2,17-Diacetoxycembra-3,7,11,15-tetraene

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(1S,2R,3E,7E,11E)-2,17-Diacetoxycembra-3,7,11,15-tetraene
SpectraBase Compound ID 4gkVrwyAFoL
InChI InChI=1S/C24H36O4/c1-17-9-7-11-18(2)13-14-23(20(4)16-27-21(5)25)24(28-22(6)26)15-19(3)12-8-10-17/h10-11,15,23-24H,4,7-9,12-14,16H2,1-3,5-6H3/b17-10+,18-11+,19-15+
InChIKey YBPOQSGQBJVMKO-BBCCYVLPSA-N
Mol Weight 388.5 g/mol
Molecular Formula C24H36O4
Exact Mass 388.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7FhJiInUkk0
Name (1S,2R,3E,7E,11E)-2,17-Diacetoxycembra-3,7,11,15-tetraene
Comments Computed using HOSE algorithm
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Exact Mass 388.261359635 u
Formula C24H36O4
InChI InChI=1S/C24H36O4/c1-17-9-7-11-18(2)13-14-23(20(4)16-27-21(5)25)24(28-22(6)26)15-19(3)12-8-10-17/h10-11,15,23-24H,4,7-9,12-14,16H2,1-3,5-6H3/b17-10+,18-11+,19-15+
InChIKey YBPOQSGQBJVMKO-BBCCYVLPSA-N
Molecular Weight 388.548 g/mol
SMILES C1(\C=C\(CC\C=C\(CC\C=C\(CCC1C(=C)COC(C)=O)C)C)C)OC(=O)C