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(20S*,4R*,5R*)-4-Acetoxytricyclo[4.2.1.0(2,5)]non-7-en-3-one
SpectraBase Compound ID 7KxsCq6NS9o
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-PFAOCNCBSA-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 8Dw4yIXgr3K
Name (20S*,4R*,5R*)-4-Acetoxytricyclo[4.2.1.0(2,5)]non-7-en-3-one
Alternate Name(s) (2R,3R,5S)-4-oxotricyclo[4.2.1.0(2,5)]non-7-en-3-yl acetate
CAS Registry Number 67737-78-4
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-PFAOCNCBSA-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 splash10-00pi-9200000000-f12744e047adaaa6ca9c
Source of Spectrum J-43-4563-0
Wiley ID 1188348