For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2,4-Pentanedione, 3-(6-oxobicyclo[3.2.0]hept-3-en-2-yl)-, (1.alpha.,2.alpha.,5.alpha.)-
SpectraBase Compound ID 6Umep85PW7h
InChI InChI=1S/C12H14O3/c1-6(13)12(7(2)14)9-4-3-8-10(9)5-11(8)15/h3-4,8-10,12H,5H2,1-2H3/t8-,9-,10-/m1/s1
InChIKey JJTJAIVVRFMBTP-OPRDCNLKSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 64bpUBWTRGf
Name 2,4-Pentanedione, 3-(6-oxobicyclo[3.2.0]hept-3-en-2-yl)-, (1.alpha.,2.alpha.,5.alpha.)-
CAS Registry Number 88491-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-6(13)12(7(2)14)9-4-3-8-10(9)5-11(8)15/h3-4,8-10,12H,5H2,1-2H3/t8-,9-,10-/m1/s1
InChIKey JJTJAIVVRFMBTP-OPRDCNLKSA-N
Molecular Weight 206.241 g/mol
SMILES [C@]1([C@]2([C@@]([H])(C=C1)C(C2)=O)[H])(C(C(=O)C)C(=O)C)[H]
SPLASH splash10-00di-1900000000-47d319a84cadf8bc56b7
Source of Spectrum H-66-1888-0
Synonyms 3-[(1S,2R,5R)-6-oxobicyclo[3.2.0]hept-3-en-2-yl]-2,4-pentanedione 4exo-(2',4'-dioxopent-3'-yl)bicyclo[3.2.0]hept-2-en-7-one Bicyclo[3.2.0]heptane, 2,4-pentanedione deriv.
Wiley ID 1204384