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1,5-bis(1-((2-chlorothiazol-5-yl)methyl)-4,5-dihydro-1H-imidazolidine-2-yl)-1,5-dinitro-1,4-pentadiene
SpectraBase Compound ID FHi7Z8MCU3y
InChI InChI=1S/C19H18Cl2N8O4S2/c20-18-24-8-12(34-18)10-26-6-4-22-16(26)14(28(30)31)2-1-3-15(29(32)33)17-23-5-7-27(17)11-13-9-25-19(21)35-13/h2-3,8-9H,1,4-7,10-11H2
InChIKey ZDTQNKPWCVVDNW-UHFFFAOYSA-N
Mol Weight 557.43 g/mol
Molecular Formula C19H18Cl2N8O4S2
Exact Mass 556.026949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3PmtJGrwYB
Name 1,5-bis(1-((2-chlorothiazol-5-yl)methyl)-4,5-dihydro-1H-imidazolidine-2-yl)-1,5-dinitro-1,4-pentadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18Cl2N8O4S2
InChI InChI=1S/C19H18Cl2N8O4S2/c20-18-24-8-12(34-18)10-26-6-4-22-16(26)14(28(30)31)2-1-3-15(29(32)33)17-23-5-7-27(17)11-13-9-25-19(21)35-13/h2-3,8-9H,1,4-7,10-11H2
InChIKey ZDTQNKPWCVVDNW-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 557.431 g/mol
SMILES C(=CCC=C([N+](=O)[O-])C1=NCCN1Cc1cnc(s1)Cl)([N+](=O)[O-])C1=NCCN1Cc1cnc(s1)Cl
SPLASH splash10-001i-0920000000-fbb6fe4ad48f44dd9040
Source of Spectrum CN101747320A
Wiley ID 1841663