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(2S*,4S*,5R*)-4-Acetoxytricyclo[4.2.1.0(2,5)]non-7-en-3-one
SpectraBase Compound ID FyEKsBkYyFs
InChI InChI=1S/C11H12O3/c1-5(12)14-11-9-7-3-2-6(4-7)8(9)10(11)13/h2-3,6-9,11H,4H2,1H3/t6?,7?,8-,9+,11-/m0/s1
InChIKey FMYJZUHQEWTUTH-SCVXPFHZSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 86hGm8MdSyl
Name (2S*,4S*,5R*)-4-Acetoxytricyclo[4.2.1.0(2,5)]non-7-en-3-one
CAS Registry Number 67737-79-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-5(12)14-11-9-7-3-2-6(4-7)8(9)10(11)13/h2-3,6-9,11H,4H2,1H3/t6?,7?,8-,9+,11-/m0/s1
InChIKey FMYJZUHQEWTUTH-SCVXPFHZSA-N
Molecular Weight 192.214 g/mol
SMILES C1([C@]2(C3C=CC([C@]2([C@@]1(OC(=O)C)[H])[H])C3)[H])=O
SPLASH splash10-014i-9100000000-1ed18fcc188fdab9643b
Source of Spectrum J-43-4563-0
Synonyms (2R,3S,5S)-4-oxotricyclo[4.2.1.0(2,5)]non-7-en-3-yl acetate
Wiley ID 1188349