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.epsilon.-Cyt-PFB Derivative
SpectraBase Compound ID CZMJRn1BK6a
InChI InChI=1S/C13H6F5N3O/c14-8-6(9(15)11(17)12(18)10(8)16)5-20-3-1-7-19-2-4-21(7)13(20)22/h1-4H,5H2
InChIKey GDQRBZDTEGQWNH-UHFFFAOYSA-N
Mol Weight 315.2 g/mol
Molecular Formula C13H6F5N3O
Exact Mass 315.043103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ls4y1xHn3X4
Name .epsilon.-Cyt-PFB Derivative
Alternate Name(s) 3,N(4)-Ethenocytosine-Pentafluorobenzyl Derivative
Comments Less than 3 mono-isotopic peaks
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Formula C13H6F5N3O
InChI InChI=1S/C13H6F5N3O/c14-8-6(9(15)11(17)12(18)10(8)16)5-20-3-1-7-19-2-4-21(7)13(20)22/h1-4H,5H2
InChIKey GDQRBZDTEGQWNH-UHFFFAOYSA-N
Molecular Weight 315.203 g/mol
SMILES C1([n]2c(C=CN1Cc1c(c(F)c(c(c1F)F)F)F)ncc2)=O
SPLASH splash10-001i-0900000000-6759c55a3ee4e931a92c
Source of Spectrum CRT-14-1613-A
Wiley ID 1709882