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(2R,5S,6S)-5-benzyloxymethyl-4-oxaendo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one

View entire compound with spectra: 1 MS (GC)

(2R,5S,6S)-5-benzyloxymethyl-4-oxaendo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
SpectraBase Compound ID BLiNcLwvgKE
InChI InChI=1S/C17H18O3/c18-17-16-13-7-6-12(8-13)15(16)14(20-17)10-19-9-11-4-2-1-3-5-11/h1-7,12-16H,8-10H2/t12?,13?,14-,15-,16-/m1/s1
InChIKey AOOOYUWUQDKLPB-KDQUWOQTSA-N
Mol Weight 270.33 g/mol
Molecular Formula C17H18O3
Exact Mass 270.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApxNzNtV4l0
Name (2R,5S,6S)-5-benzyloxymethyl-4-oxaendo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
CAS Registry Number 111613-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O3
InChI InChI=1S/C17H18O3/c18-17-16-13-7-6-12(8-13)15(16)14(20-17)10-19-9-11-4-2-1-3-5-11/h1-7,12-16H,8-10H2/t12?,13?,14-,15-,16-/m1/s1
InChIKey AOOOYUWUQDKLPB-KDQUWOQTSA-N
Molecular Weight 270.328 g/mol
SMILES C1(O[C@](COCc2ccccc2)([C@]2(C3C=CC([C@@]12[H])C3)[H])[H])=O
SPLASH splash10-00kf-9000000000-c26b8582eb590c14b64d
Source of Spectrum F-45-1837-7
Synonyms (2R,5S,6S)-5-[(benzyloxy)methyl]-4-oxatricyclo[5.2.1.0(2,6)]dec-8-en-3-one
Wiley ID 1274582