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(1R,2R,5R,7S)-2-Acetyl-5-benzyloxymethyl-11-oxatricyclo[5.3.1.0(1,5)]-8-undecanone
SpectraBase Compound ID 9ZpbBnXcKBU
InChI InChI=1S/C20H24O4/c1-14(21)16-7-9-19(13-23-12-15-5-3-2-4-6-15)11-18-17(22)8-10-20(16,19)24-18/h2-6,16,18H,7-13H2,1H3/t16-,18-,19+,20+/m0/s1
InChIKey PYNYANFXJYQUEG-IJXRJRJASA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XRafBO4xAV
Name (1R,2R,5R,7S)-2-Acetyl-5-benzyloxymethyl-11-oxatricyclo[5.3.1.0(1,5)]-8-undecanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-14(21)16-7-9-19(13-23-12-15-5-3-2-4-6-15)11-18-17(22)8-10-20(16,19)24-18/h2-6,16,18H,7-13H2,1H3/t16-,18-,19+,20+/m0/s1
InChIKey PYNYANFXJYQUEG-IJXRJRJASA-N
Molecular Weight 328.408 g/mol
SMILES [C@]123[C@@](C[C@](O3)(C(CC1)=O)[H])(CC[C@]2(C(=O)C)[H])COCc1ccccc1
SPLASH splash10-002g-0911000000-791087c0bac801eb7062
Source of Spectrum F-68-4204-24
Synonyms (1R,2R,5R,7S)-2-acetyl-5-[(benzyloxy)methyl]-11-oxatricyclo[5.3.1.0(1,5)]undecan-8-one
Wiley ID 1572558