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(1R,6S,7R)6-Benzyl-7-(hydroxymethyl)-2-oxabicyclo[4.1.0]heptane
SpectraBase Compound ID ITPP2bK6Q4W
InChI InChI=1S/C14H18O2/c15-10-12-13-14(12,7-4-8-16-13)9-11-5-2-1-3-6-11/h1-3,5-6,12-13,15H,4,7-10H2/t12-,13-,14+/m1/s1
InChIKey VAOBPQFGMLYYNA-MCIONIFRSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3J23kluncy3
Name (1R,6S,7R)6-Benzyl-7-(hydroxymethyl)-2-oxabicyclo[4.1.0]heptane
Alternate Name(s) (1R,6S,7R)65-Benzyl-7-(hydroxymethyl)-2-oxabicyclo[4.1.0]heptane [(1R,6S,7R)-6-benzyl-2-oxabicyclo[4.1.0]hept-7-yl]methanol
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Formula C14H18O2
InChI InChI=1S/C14H18O2/c15-10-12-13-14(12,7-4-8-16-13)9-11-5-2-1-3-6-11/h1-3,5-6,12-13,15H,4,7-10H2/t12-,13-,14+/m1/s1
InChIKey VAOBPQFGMLYYNA-MCIONIFRSA-N
Molecular Weight 218.296 g/mol
SMILES OC[C@]1([C@@]2([C@@]1(OCCC2)[H])Cc1ccccc1)[H]
SPLASH splash10-00kf-9300000000-41b6a0c12139f8e3c8bb
Source of Spectrum J-63-6014-38
Wiley ID 1218062