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(R,R,R)-Methyl 4-(2,7-dioxabicyclo[3.2.1]octan-8 -ylmethyl)benzoate
SpectraBase Compound ID JdcZF0uGsLf
InChI InChI=1S/C15H18O4/c1-17-14(16)11-4-2-10(3-5-11)8-13-12-6-7-18-15(13)19-9-12/h2-5,12-13,15H,6-9H2,1H3/t12-,13+,15+/m0/s1
InChIKey JMJHTLXIAJIQEO-GZBFAFLISA-N
Mol Weight 262.3 g/mol
Molecular Formula C15H18O4
Exact Mass 262.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4sai8pcVtO8
Name (R,R,R)-Methyl 4-(2,7-dioxabicyclo[3.2.1]octan-8 -ylmethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O4
InChI InChI=1S/C15H18O4/c1-17-14(16)11-4-2-10(3-5-11)8-13-12-6-7-18-15(13)19-9-12/h2-5,12-13,15H,6-9H2,1H3/t12-,13+,15+/m0/s1
InChIKey JMJHTLXIAJIQEO-GZBFAFLISA-N
Literature Reference DOI 10.1002/adsc.200900494
Molecular Weight 262.305 g/mol
SMILES [C@@]12(OCC[C@](CO2)([H])[C@]1(Cc1ccc(cc1)C(OC)=O)[H])[H]
SPLASH splash10-003r-2910000000-37a58c843394e4e6222e
Source of Spectrum ASC-351-2921/SM33-4h
Synonyms Methyl 4-((1R,5R,8R)-2,7-dioxabicyclo[3.2.1]octan-8-ylmethyl)benzoate
Wiley ID 1763547