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1-[bis(Ethoxycarbonyl)methyl]-2-oxo-3-isopropyl-4-methyl-5,6-benzo-1,4-diazacycloheptane
SpectraBase Compound ID 58gIXz63RMU
InChI InChI=1S/C20H28N2O5/c1-6-26-19(24)17(20(25)27-7-2)22-12-14-10-8-9-11-15(14)21(5)16(13(3)4)18(22)23/h8-11,13,16-17H,6-7,12H2,1-5H3/t16-/m0/s1
InChIKey FJCSXKKGRFMPCZ-INIZCTEOSA-N
Mol Weight 376.45 g/mol
Molecular Formula C20H28N2O5
Exact Mass 376.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMN5OBTdqpl
Name 1-[bis(Ethoxycarbonyl)methyl]-2-oxo-3-isopropyl-4-methyl-5,6-benzo-1,4-diazacycloheptane
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28N2O5
InChI InChI=1S/C20H28N2O5/c1-6-26-19(24)17(20(25)27-7-2)22-12-14-10-8-9-11-15(14)21(5)16(13(3)4)18(22)23/h8-11,13,16-17H,6-7,12H2,1-5H3/t16-/m0/s1
InChIKey FJCSXKKGRFMPCZ-INIZCTEOSA-N
Molecular Weight 376.453 g/mol
SMILES C1(N(Cc2c(N([C@]1(C(C)C)[H])C)cccc2)C(C(=O)OCC)C(=O)OCC)=O
SPLASH splash10-056r-6219000000-eb49c4996e6e201815c9
Source of Spectrum C-120-12466-32
Wiley ID 1699945