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2-(6-Methylbicyclo[3.2.1]oct-6-en-2-on-l-yl)propinoic acid
SpectraBase Compound ID LEZDWI3Cdcx
InChI InChI=1S/C12H16O3/c1-7-5-12(8(2)11(14)15)6-9(7)3-4-10(12)13/h5,8-9H,3-4,6H2,1-2H3,(H,14,15)
InChIKey WVBDLBBGNFSKHI-UHFFFAOYSA-N
Mol Weight 208.26 g/mol
Molecular Formula C12H16O3
Exact Mass 208.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hn6y9vuEStw
Name 2-(6-Methylbicyclo[3.2.1]oct-6-en-2-on-l-yl)propinoic acid
Alternate Name(s) 2-(6-Methyl-2-oxobicyclo[3.2.1]oct-6-en-1-yl)propanoic acid
CAS Registry Number 67315-96-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3
InChI InChI=1S/C12H16O3/c1-7-5-12(8(2)11(14)15)6-9(7)3-4-10(12)13/h5,8-9H,3-4,6H2,1-2H3,(H,14,15)
InChIKey WVBDLBBGNFSKHI-UHFFFAOYSA-N
Molecular Weight 208.257 g/mol
SMILES OC(C(C12C=C(C)C(C2)CCC1=O)C)=O
SPLASH splash10-0a4i-1910000000-965cafe53fd41ba04bdd
Source of Spectrum J-43-4067-0
Wiley ID 1206828