SpectraBase Spectrum ID |
Cg7LL5HYRP7 |
Name |
HEXAHYDRO-2H-AZEPINE-delta2,alpha-MALONIC ACID, CYCLIC ISOPROPYLIDENE ESTER |
Source of Sample |
J. P. Celerier, University of Pierre and Marie Curie, Paris, France |
Comments |
Tentative assignment |
Copyright |
Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H17NO4 |
InChI |
InChI=1S/C12H17NO4/c1-12(2)16-10(14)9(11(15)17-12)8-6-4-3-5-7-13-8/h13H,3-7H2,1-2H3 |
InChIKey |
IBOQRIWQBFOIGL-UHFFFAOYSA-N |
Melting Point |
147C |
Molecular Weight |
239.27 |
Solvent |
Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |