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(1RS,2SR,4SR,8RS,11SR)-7-Hydroxymethyl-10,10-dimethyltetracyclo[6.3.0.0(2,11).0(4,8)]undecane-3-one
SpectraBase Compound ID 4jDKay3TVsN
InChI InChI=1S/C14H20O2/c1-13(2)6-14-7(5-15)3-4-8(14)12(16)9-10(13)11(9)14/h7-11,15H,3-6H2,1-2H3/t7?,8-,9?,10?,11+,14-/m0/s1
InChIKey QSRBQSQXINYBPJ-ZPBWBKFJSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JtMkJYbmqKi
Name (1RS,2SR,4SR,8RS,11SR)-7-Hydroxymethyl-10,10-dimethyltetracyclo[6.3.0.0(2,11).0(4,8)]undecane-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-13(2)6-14-7(5-15)3-4-8(14)12(16)9-10(13)11(9)14/h7-11,15H,3-6H2,1-2H3/t7?,8-,9?,10?,11+,14-/m0/s1
InChIKey QSRBQSQXINYBPJ-ZPBWBKFJSA-N
Molecular Weight 220.312 g/mol
SMILES OCC1[C@@]23[C@@]4(C(C(=O)[C@@]3(CC1)[H])C4C(C)(C)C2)[H]
SPLASH splash10-001i-0930000000-af2024b4f009307eaabe
Source of Spectrum E1-38-1128-26
Synonyms (3aR,6R,6aS,6bS)-6-(hydroxymethyl)-2,2-dimethyloctahydrocyclopenta[g]cyclopropa[cd]pentalen-3(1H)-one
Wiley ID 1518334