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

*Links on SpectraBase are not permalinks.
(2aS,8bR)-1,1-Dichloro-3-oxo-1,3,4,8b-tetrahydrocyclobuta[c]quinolin-2a(2H)-yl acetate
SpectraBase Compound ID JyDAYUTaAey
InChI InChI=1S/C13H11Cl2NO3/c1-7(17)19-12-6-13(14,15)10(12)8-4-2-3-5-9(8)16-11(12)18/h2-5,10H,6H2,1H3,(H,16,18)/t10-,12+/m1/s1
InChIKey ZODHZRQNZBTHMJ-PWSUYJOCSA-N
Mol Weight 300.14 g/mol
Molecular Formula C13H11Cl2NO3
Exact Mass 299.011599 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 KWmcyPqGriS
Name (2aS,8bR)-1,1-Dichloro-3-oxo-1,3,4,8b-tetrahydrocyclobuta[c]quinolin-2a(2H)-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11Cl2NO3
InChI InChI=1S/C13H11Cl2NO3/c1-7(17)19-12-6-13(14,15)10(12)8-4-2-3-5-9(8)16-11(12)18/h2-5,10H,6H2,1H3,(H,16,18)/t10-,12+/m1/s1
InChIKey ZODHZRQNZBTHMJ-PWSUYJOCSA-N
Literature Reference DOI 10.1039/c3cc49469a
Molecular Weight 300.141 g/mol
SMILES N1C([C@]2([C@@](c3ccccc13)(C(C2)(Cl)Cl)[H])OC(C)=O)=O
SPLASH splash10-03di-3900000000-aa9a10eb339564c7a00c
Source of Spectrum KD-50-3353/SMS10-3b
Synonyms (2aS,8bR)-1,1-dichloro-3-oxo-1,2,2a,3,4,8b-hexahydrocyclobuta[c]quinolin-2a-yl acetate
Wiley ID 1754353