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(1R,2S,3R,4S)-1,7,7-trimethyl-2-neopentyloxy-3-prop-1-ynoxy-norbornane
SpectraBase Compound ID 5egDFpLq55u
InChI InChI=1S/C18H30O2/c1-8-11-19-14-13-9-10-18(7,17(13,5)6)15(14)20-12-16(2,3)4/h13-15H,9-10,12H2,1-7H3/t13-,14-,15-,18+/m1/s1
InChIKey JYFJUAZWOVXANK-ADAWSYLGSA-N
Mol Weight 278.44 g/mol
Molecular Formula C18H30O2
Exact Mass 278.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1aomRIqAEx
Name (1R,2S,3R,4S)-1,7,7-trimethyl-2-neopentyloxy-3-prop-1-ynoxy-norbornane
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Formula C18H30O2
InChI InChI=1S/C18H30O2/c1-8-11-19-14-13-9-10-18(7,17(13,5)6)15(14)20-12-16(2,3)4/h13-15H,9-10,12H2,1-7H3/t13-,14-,15-,18+/m1/s1
InChIKey JYFJUAZWOVXANK-ADAWSYLGSA-N
Molecular Weight 278.436 g/mol
SMILES [C@]12(C([C@]([H])(CC2)[C@]([C@]1(OCC(C)(C)C)[H])(OC#CC)[H])(C)C)C
SPLASH splash10-006x-9300000000-548a3436242cffdbaa6b
Source of Spectrum J-58-1868-10
Synonyms (1R,2S,3R,4S)-2-(2,2-dimethylpropoxy)-1,7,7-trimethyl-3-prop-1-ynoxy-norbornane (1S,2R,3S,4R)-3-(2,2-dimethylpropoxy)-4,7,7-trimethyl-2-prop-1-ynoxy-bicyclo[2.2.1]heptane
Wiley ID 1282492