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PFP-acyl derivative of DopAg
SpectraBase Compound ID 8rQw6TSRHkO
InChI InChI=1S/C18H20F5NO3/c1-2-7-24-8-9-26-15-13-10-12(5-3-11(13)4-6-14(15)24)27-16(25)17(19,20)18(21,22)23/h3,5,10,14-15H,2,4,6-9H2,1H3/t14-,15-/m0/s1
InChIKey SWDBIVWBCBOZDH-GJZGRUSLSA-N
Mol Weight 393.35 g/mol
Molecular Formula C18H20F5NO3
Exact Mass 393.136334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 14MsLHiieG
Name PFP-acyl derivative of DopAg
Alternate Name(s) (+)-trans-3,4,4a,5,6,10b-hexahydro-4-propyl-9-pentafluoropropionyloxy-2H-naphth[[1,2-b]-(1,4)-oxazine (4aS,10bS)-4-propyl-3,4,4a,5,6,10b-hexahydro-2H-naphtho[1,2-b][1,4]oxazin-9-yl 2,2,3,3,3-pentafluoropropanoate
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Formula C18H20F5NO3
InChI InChI=1S/C18H20F5NO3/c1-2-7-24-8-9-26-15-13-10-12(5-3-11(13)4-6-14(15)24)27-16(25)17(19,20)18(21,22)23/h3,5,10,14-15H,2,4,6-9H2,1H3/t14-,15-/m0/s1
InChIKey SWDBIVWBCBOZDH-GJZGRUSLSA-N
Molecular Weight 393.354 g/mol
SMILES C(C(Oc1cc2[C@]3([C@](N(CCC)CCO3)([H])CCc2cc1)[H])=O)(C(F)(F)F)(F)F
SPLASH splash10-014i-9835000000-ee76aadb8dbf711c9956
Source of Spectrum KO-17-296-5
Wiley ID 1366190