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(4R,5R)-(-)-3-[(Benzyloxy)methyl]-4,5-O-isopropylidene-2-cyclopentenone
SpectraBase Compound ID 7wtQvHFx2K0
InChI InChI=1S/C16H18O4/c1-16(2)19-14-12(8-13(17)15(14)20-16)10-18-9-11-6-4-3-5-7-11/h3-8,14-15H,9-10H2,1-2H3/t14-,15+/m1/s1
InChIKey IMMAKCSFQZGDHG-CABCVRRESA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FSNn9m6xpIa
Name (4R,5R)-(-)-3-[(Benzyloxy)methyl]-4,5-O-isopropylidene-2-cyclopentenone
Alternate Name(s) (3aR,6aR)-6-(benzyloxymethyl)-2,2-dimethyl-3a,6a-dihydrocyclopenta[d][1,3]dioxol-4-one (3aR,6aR)-2,2-dimethyl-6-(phenylmethoxymethyl)-3a,6a-dihydrocyclopenta[d][1,3]dioxol-4-one
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Formula C16H18O4
InChI InChI=1S/C16H18O4/c1-16(2)19-14-12(8-13(17)15(14)20-16)10-18-9-11-6-4-3-5-7-11/h3-8,14-15H,9-10H2,1-2H3/t14-,15+/m1/s1
InChIKey IMMAKCSFQZGDHG-CABCVRRESA-N
Molecular Weight 274.316 g/mol
SMILES [C@]12([C@@](C(COCc3ccccc3)=CC1=O)(OC(O2)(C)C)[H])[H]
SPLASH splash10-0006-9500000000-21266e676db92d448598
Source of Spectrum F-56-4645-25
Wiley ID 856733