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11,23-Difluoro-1,9,13,21-tetraaza-tricyclo[19.3.1.1*9,13*]hexacosa-11,23-diene-10,22,25,26-tetraone
SpectraBase Compound ID CtiOVmHwsIL
InChI InChI=1S/C22H30F2N4O4/c23-17-15-25-11-7-3-1-5-9-13-27-19(29)18(24)16-26(22(27)32)12-8-4-2-6-10-14-28(20(17)30)21(25)31/h15-16H,1-14H2
InChIKey JRGZTFZZJLRUSX-UHFFFAOYSA-N
Mol Weight 452.5 g/mol
Molecular Formula C22H30F2N4O4
Exact Mass 452.223512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYOyxgmO6BH
Name 11,23-Difluoro-1,9,13,21-tetraaza-tricyclo[19.3.1.1*9,13*]hexacosa-11,23-diene-10,22,25,26-tetraone
Alternate Name(s) 11,23-difluoro-1,9,13,21-tetraazatricyclo[19.3.1.1(9,13)]hexacosa-11,23-diene-10,22,25,26-tetrone 11,23-Difluoro-1,9,13,21-tetrazatricyclo[19.3.1.1]hexacosa-11,23-dien-10,22,25,26-tetrone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30F2N4O4
InChI InChI=1S/C22H30F2N4O4/c23-17-15-25-11-7-3-1-5-9-13-27-19(29)18(24)16-26(22(27)32)12-8-4-2-6-10-14-28(20(17)30)21(25)31/h15-16H,1-14H2
InChIKey JRGZTFZZJLRUSX-UHFFFAOYSA-N
Molecular Weight 452.503 g/mol
SMILES C1(N2CCCCCCCN3C(N(CCCCCCCN1C=C(C2=O)F)C(C(=C3)F)=O)=O)=O
SPLASH splash10-0udi-0900700000-f6b847ba1e81813749dc
Source of Spectrum AJ-69-3243-2
Wiley ID 773912