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

*Links on SpectraBase are not permalinks.
Dimethyl N-[Di(ethoxycarbonyl)methyl]-11-azatricyclo[5.4.0.1(2,5)]undeca-tetraene-3,4-dicarboxylate
SpectraBase Compound ID NnOGwJwJSj
InChI InChI=1S/C21H23NO8/c1-5-29-20(25)17(21(26)30-6-2)22-15-11-9-7-8-10-12(11)16(22)14(19(24)28-4)13(15)18(23)27-3/h7-10,15-17H,5-6H2,1-4H3/t15-,16+
InChIKey ZJXIIDBRSGGYFL-IYBDPMFKSA-N
Mol Weight 417.41 g/mol
Molecular Formula C21H23NO8
Exact Mass 417.142367 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 3lUFMgi7uGm
Name Dimethyl N-[Di(ethoxycarbonyl)methyl]-11-azatricyclo[5.4.0.1(2,5)]undeca-tetraene-3,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO8
InChI InChI=1S/C21H23NO8/c1-5-29-20(25)17(21(26)30-6-2)22-15-11-9-7-8-10-12(11)16(22)14(19(24)28-4)13(15)18(23)27-3/h7-10,15-17H,5-6H2,1-4H3/t15-,16+
InChIKey ZJXIIDBRSGGYFL-IYBDPMFKSA-N
Molecular Weight 417.414 g/mol
SMILES C1(=C([C@@]2(c3ccccc3[C@]1(N2C(C(=O)OCC)C(=O)OCC)[H])[H])C(=O)OC)C(=O)OC
SPLASH splash10-03di-0059000000-c176fddb191bdc944c0f
Source of Spectrum F-66-181-14a
Wiley ID 1682867