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Methyl 3-((1S,1aR,4aR,7S,7aS,7bR)-7-hydroxy-1,7-dimethyl-4-oxodecahydro-1H-cyclopropa[e]azulen-1-yl)propanoate
SpectraBase Compound ID JUpgnhDL3zO
InChI InChI=1S/C17H26O4/c1-16(8-7-13(19)21-3)11-4-5-12(18)10-6-9-17(2,20)14(10)15(11)16/h10-11,14-15,20H,4-9H2,1-3H3/t10-,11+,14+,15+,16-,17-/m0/s1
InChIKey ABUMZPLZTGGZII-LILZGBFPSA-N
Mol Weight 294.39 g/mol
Molecular Formula C17H26O4
Exact Mass 294.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 632pUEIRShr
Name Methyl 3-((1S,1aR,4aR,7S,7aS,7bR)-7-hydroxy-1,7-dimethyl-4-oxodecahydro-1H-cyclopropa[e]azulen-1-yl)propanoate
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Formula C17H26O4
InChI InChI=1S/C17H26O4/c1-16(8-7-13(19)21-3)11-4-5-12(18)10-6-9-17(2,20)14(10)15(11)16/h10-11,14-15,20H,4-9H2,1-3H3/t10-,11+,14+,15+,16-,17-/m0/s1
InChIKey ABUMZPLZTGGZII-LILZGBFPSA-N
Literature Reference DOI 10.1002/cber.19801131217
Molecular Weight 294.391 g/mol
SMILES O[C@@]1([C@@]2([C@@]([H])(CC1)C(CC[C@]1([C@@]([C@@]21[H])(CCC(=O)OC)C)[H])=O)[H])C
SPLASH splash10-0a59-9410000000-2b1c88aed1404dc916f9
Source of Spectrum K-113-3862-26
Wiley ID 1794388