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3-Oxabicyclo[3.3.1]nonan-2-one, 1-[4-(acetyloxy)-3-oxobutyl]-4,4,8-trimethyl-, (1S-endo)-
SpectraBase Compound ID EfIA9JZZ0fN
InChI InChI=1S/C17H26O5/c1-11-5-6-13-9-17(11,15(20)22-16(13,3)4)8-7-14(19)10-21-12(2)18/h11,13H,5-10H2,1-4H3/t11?,13?,17-/m0/s1
InChIKey FFQZBZYTIKFAGH-YUNLISADSA-N
Mol Weight 310.39 g/mol
Molecular Formula C17H26O5
Exact Mass 310.178024 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UmzvqLMBM2
Name 3-Oxabicyclo[3.3.1]nonan-2-one, 1-[4-(acetyloxy)-3-oxobutyl]-4,4,8-trimethyl-, (1S-endo)-
CAS Registry Number 90250-91-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O5
InChI InChI=1S/C17H26O5/c1-11-5-6-13-9-17(11,15(20)22-16(13,3)4)8-7-14(19)10-21-12(2)18/h11,13H,5-10H2,1-4H3/t11?,13?,17-/m0/s1
InChIKey FFQZBZYTIKFAGH-YUNLISADSA-N
Molecular Weight 310.390 g/mol
SMILES [C@]12(C(OC(C(C2)CCC1C)(C)C)=O)CCC(=O)COC(=O)C
SPLASH splash10-052s-5590000000-072a30f1745bfbb369c8
Source of Spectrum KC-1984-220-0
Synonyms (1S,7S,10R)-14-Acetoxy-4-oxo-4,5:6,11-disecovitrane-5,11-carbolactone 2-Oxo-4-[(1S)-4,4,8-trimethyl-2-oxo-3-oxabicyclo[3.3.1]non-1-yl]butyl acetate
Wiley ID 1311505