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5',5''-dinitrodibenzodiaza-15-crown-5
SpectraBase Compound ID LMFfk6iVPaK
InChI InChI=1S/C18H20N4O7/c23-21(24)13-1-3-15-17(11-13)28-9-7-27-8-10-29-18-12-14(22(25)26)2-4-16(18)20-6-5-19-15/h1-4,11-12,19-20H,5-10H2
InChIKey ZXVLBDJWKRAATR-UHFFFAOYSA-N
Mol Weight 404.38 g/mol
Molecular Formula C18H20N4O7
Exact Mass 404.133199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiDipW30ku1
Name 5',5''-dinitrodibenzodiaza-15-crown-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N4O7
InChI InChI=1S/C18H20N4O7/c23-21(24)13-1-3-15-17(11-13)28-9-7-27-8-10-29-18-12-14(22(25)26)2-4-16(18)20-6-5-19-15/h1-4,11-12,19-20H,5-10H2
InChIKey ZXVLBDJWKRAATR-UHFFFAOYSA-N
Molecular Weight 404.379 g/mol
SMILES N1CCNc2ccc(N(=O)=O)cc2OCCOCCOc2cc(N(=O)=O)ccc12
SPLASH splash10-00ks-1904100000-bc52fa518b7793fc87f0
Source of Spectrum F-67-2533-4a
Wiley ID 1686151