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TREMULENOLIDE_A
SpectraBase Compound ID 4km4qwvxcA
InChI InChI=1S/C15H22O2/c1-9-4-5-10-8-17-14(16)13(10)12-7-15(2,3)6-11(9)12/h9-11H,4-8H2,1-3H3/t9-,10+,11-/m0/s1
InChIKey BQADRYZOMNHMRC-AXFHLTTASA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rAow6GDunO
Name (3aS,6S,6aS)-6,8,8-trimethyl-3,3a,4,5,6,6a,7,9-octahydroazuleno[4,5-c]furan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-9-4-5-10-8-17-14(16)13(10)12-7-15(2,3)6-11(9)12/h9-11H,4-8H2,1-3H3/t9-,10+,11-/m0/s1
InChIKey BQADRYZOMNHMRC-AXFHLTTASA-N
Molecular Weight 234.339 g/mol
SMILES C12=C3C(OC[C@]3(CC[C@@]([C@@]1(CC(C2)(C)C)[H])(C)[H])[H])=O
SPLASH splash10-014i-0090000000-3627d0210ef08362934e
Source of Spectrum J-63-660-1
Wiley ID 1236501