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(1R,3S,6S,7R)-12-(Methoxycarbonyl)-2-oxa-4,4,7-trimethyltricyclo[6.3.1.0(1,6)]dodecan-11-one
SpectraBase Compound ID 1UJ867NG0tt
InChI InChI=1S/C16H24O4/c1-9-5-6-16-8-11(17)12(14(18)19-4)13(20-16)15(2,3)7-10(9)16/h9-10,12-13H,5-8H2,1-4H3/t9-,10+,12?,13-,16+/m1/s1
InChIKey ZSLYZHDFDXTBIO-BMMRSJIRSA-N
Mol Weight 280.36 g/mol
Molecular Formula C16H24O4
Exact Mass 280.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jn3DgPh5b9h
Name (1R,3S,6S,7R)-12-(Methoxycarbonyl)-2-oxa-4,4,7-trimethyltricyclo[6.3.1.0(1,6)]dodecan-11-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H24O4
InChI InChI=1S/C16H24O4/c1-9-5-6-16-8-11(17)12(14(18)19-4)13(20-16)15(2,3)7-10(9)16/h9-10,12-13H,5-8H2,1-4H3/t9-,10+,12?,13-,16+/m1/s1
InChIKey ZSLYZHDFDXTBIO-BMMRSJIRSA-N
Molecular Weight 280.364 g/mol
SMILES [C@]123O[C@@](C(C[C@]3([C@](C)(CC1)[H])[H])(C)C)(C(C(C2)=O)C(=O)OC)[H]
SPLASH splash10-001i-0970000000-8576b6b737553a0a0390
Source of Spectrum J-60-4564-5
Synonyms (1S,4R,5S,8R)-4,7,7-Trimethyl-10-oxo-12-oxa-tricyclo[6.3.1.0*1,5*]dodecane-9-carboxylic acid methyl ester methyl (1R,6S,7R,12R)-4,4,7-trimethyl-11-oxo-2-oxatricyclo[6.3.1.0(1,6)]dodecane-12-carboxylate
Wiley ID 1284013