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PENTAFLUOROPHENYL-4-[(9-FLUORENYLMETHOXYCARBONYL)-AMINO]-1-METHYLPYRROLE-2-CARBOXYLATE
SpectraBase Compound ID 4gJWahqY2lr
InChI InChI=1S/C27H17F5N2O4/c1-34-11-13(10-19(34)26(35)38-25-23(31)21(29)20(28)22(30)24(25)32)33-27(36)37-12-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11,18H,12H2,1H3,(H,33,36)
InChIKey JMUADURZPRDHOF-UHFFFAOYSA-N
Mol Weight 528.44 g/mol
Molecular Formula C27H17F5N2O4
Exact Mass 528.110848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 357IYIeYO8
Name (2,3,4,5,6-pentafluorophenyl) 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-methyl-pyrrole-2-carboxylate
Alternate Name(s) 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-methyl-pyrrole-2-carboxylic acid (2,3,4,5,6-pentafluorophenyl) ester 4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-1-methyl-2-pyrrolecarboxylic acid (2,3,4,5,6-pentafluorophenyl) ester (2,3,4,5,6-pentafluorophenyl) 4-(9H-fluoren-9-ylmethoxycarbonylamino)-1-methylpyrrole-2-carboxylate
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Formula C27H17F5N2O4
InChI InChI=1S/C27H17F5N2O4/c1-34-11-13(10-19(34)26(35)38-25-23(31)21(29)20(28)22(30)24(25)32)33-27(36)37-12-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-11,18H,12H2,1H3,(H,33,36)
InChIKey JMUADURZPRDHOF-UHFFFAOYSA-N
Molecular Weight 528.435 g/mol
SMILES N(C(OCC1c2c(cccc2)-c2c1cccc2)=O)c1cc(C(Oc2c(c(F)c(c(c2F)F)F)F)=O)[n](c1)C
SPLASH splash10-002b-0901000000-c4c559338628a5606283
Source of Spectrum SK-29-946-3
Wiley ID 880477