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2(N)-Methyl-1,3-dioxo-8-( 8'-acetoxyoctyl)-5-butyl-2,4,9-triazabicyclo[4.3.0(4,9)]non-6-ene
SpectraBase Compound ID 5MIj3ILmdNo
InChI InChI=1S/C21H35N3O4/c1-4-5-12-18-14-15-19(24-21(27)22(3)20(26)23(18)24)13-10-8-6-7-9-11-16-28-17(2)25/h14-15,18-19H,4-13,16H2,1-3H3
InChIKey MHNFNAITFJTNDR-UHFFFAOYSA-N
Mol Weight 393.5 g/mol
Molecular Formula C21H35N3O4
Exact Mass 393.262757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Kfc6o6n4xL
Name 2(N)-Methyl-1,3-dioxo-8-( 8'-acetoxyoctyl)-5-butyl-2,4,9-triazabicyclo[4.3.0(4,9)]non-6-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H35N3O4
InChI InChI=1S/C21H35N3O4/c1-4-5-12-18-14-15-19(24-21(27)22(3)20(26)23(18)24)13-10-8-6-7-9-11-16-28-17(2)25/h14-15,18-19H,4-13,16H2,1-3H3
InChIKey MHNFNAITFJTNDR-UHFFFAOYSA-N
Molecular Weight 393.528 g/mol
SMILES C1(N(C(N2C(C=CC(N12)CCCC)CCCCCCCCOC(=O)C)=O)C)=O
SPLASH splash10-00xr-6692000000-e7e60a35e496ce1dcd5f
Source of Spectrum G-66-1688-0
Wiley ID 813302