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3,5-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1,2,4-oxadiazole

View entire compound with spectra: 1 MS (GC)

3,5-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1,2,4-oxadiazole
SpectraBase Compound ID 6Z1Sp0csQty
InChI InChI=1S/C16F30N2O/c17-3(18,5(21,22)7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)43)1-47-2(49-48-1)4(19,20)6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(44,45)46
InChIKey RQOQQUXPEGXUBM-UHFFFAOYSA-N
Mol Weight 806.14 g/mol
Molecular Formula C16F30N2O
Exact Mass 805.953158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmQpWHgT6cs
Name 3,5-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1,2,4-oxadiazole
Alternate Name(s) 3,5-bis[1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecakis(fluoranyl)heptyl]-1,2,4-oxadiazole
CAS Registry Number 4314-47-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16F30N2O
InChI InChI=1S/C16F30N2O/c17-3(18,5(21,22)7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)43)1-47-2(49-48-1)4(19,20)6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(44,45)46
InChIKey RQOQQUXPEGXUBM-UHFFFAOYSA-N
Molecular Weight 806.141 g/mol
SMILES C(F)(C(C(C(c1nc(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)on1)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)F
SPLASH splash10-00kr-8700900200-f4deba474d9cd418dd51
Source of Spectrum O-12-72-1
Wiley ID 1417226