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4-[(2-Perfluorodecyl)ethyl]-benzyl crotonate
SpectraBase Compound ID JQMe9PPNJWF
InChI InChI=1S/C23H15F21O2/c1-2-3-13(45)46-10-12-6-4-11(5-7-12)8-9-14(24,25)15(26,27)16(28,29)17(30,31)18(32,33)19(34,35)20(36,37)21(38,39)22(40,41)23(42,43)44/h2-7H,8-10H2,1H3/b3-2+
InChIKey RYAOZBRVBFZKJH-NSCUHMNNSA-N
Mol Weight 722.34 g/mol
Molecular Formula C23H15F21O2
Exact Mass 722.073671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2n8tZgaVOdZ
Name 4-[(2-Perfluorodecyl)ethyl]-benzyl crotonate
Alternate Name(s) 4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)benzyl (2E)-2-butenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15F21O2
InChI InChI=1S/C23H15F21O2/c1-2-3-13(45)46-10-12-6-4-11(5-7-12)8-9-14(24,25)15(26,27)16(28,29)17(30,31)18(32,33)19(34,35)20(36,37)21(38,39)22(40,41)23(42,43)44/h2-7H,8-10H2,1H3/b3-2+
InChIKey RYAOZBRVBFZKJH-NSCUHMNNSA-N
Molecular Weight 722.337 g/mol
SMILES C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(CCc1ccc(cc1)COC(\C=C\C)=O)(F)F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0f79-0900004000-74b16a2e17d940a530b0
Source of Spectrum KC-57-5250-531
Wiley ID 1624587