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1,2-Bis(methoxycarbonyl)-3-[2-anilino-2-(3-fluorophenyl)ethyl]guanidine
SpectraBase Compound ID B4LLUdoodLA
InChI InChI=1S/C19H21FN4O4/c1-27-18(25)23-17(24-19(26)28-2)21-12-16(13-7-6-8-14(20)11-13)22-15-9-4-3-5-10-15/h3-11,16,22H,12H2,1-2H3,(H2,21,23,24,25,26)
InChIKey NBHRUNBCBCDAIB-UHFFFAOYSA-N
Mol Weight 388.4 g/mol
Molecular Formula C19H21FN4O4
Exact Mass 388.154683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yiHLvPlfVj
Name 1,2-Bis(methoxycarbonyl)-3-[2-anilino-2-(3-fluorophenyl)ethyl]guanidine
Comments Less than 3 mono-isotopic peaks
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Formula C19H21FN4O4
InChI InChI=1S/C19H21FN4O4/c1-27-18(25)23-17(24-19(26)28-2)21-12-16(13-7-6-8-14(20)11-13)22-15-9-4-3-5-10-15/h3-11,16,22H,12H2,1-2H3,(H2,21,23,24,25,26)
InChIKey NBHRUNBCBCDAIB-UHFFFAOYSA-N
Molecular Weight 388.399 g/mol
SMILES N(\C(NCC(c1cc(ccc1)F)Nc1ccccc1)=N\C(=O)OC)C(=O)OC
SPLASH splash10-0udi-0090000000-e09cc41b8f831d30c8bc
Source of Spectrum SO-0-665-4
Synonyms methyl (E)-{[2-anilino-2-(3-fluorophenyl)ethyl]amino}[(methoxycarbonyl)amino]methylidenecarbamate
Wiley ID 1543285