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1-Pyrrolidinyloxy, 2-(4-fluorophenyl)-5-hexadecyl-2,5-dimethyl-, trans-
SpectraBase Compound ID COhNtd9qcg3
InChI InChI=1S/C28H47FNO/c1-5-6-7-8-9-10-11-12-13-14-26(28(4)22-21-24(3)30(28)31)18-15-23(2)25-16-19-27(29)20-17-25/h16-17,19-20,23-24,26H,5-15,18,21-22H2,1-4H3/t23?,24-,26?,28-/m1/s1
InChIKey ZRFYEWUIRRWZAV-TWPJSWCISA-N
Mol Weight 433.7 g/mol
Molecular Formula C28H48FNO
Exact Mass 433.371993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID aYXTk4FTB9
Name 1-Pyrrolidinyloxy, 2-(4-fluorophenyl)-5-hexadecyl-2,5-dimethyl-, trans-
CAS Registry Number 127898-78-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H47FNO
InChI InChI=1S/C28H47FNO/c1-5-6-7-8-9-10-11-12-13-14-26(28(4)22-21-24(3)30(28)31)18-15-23(2)25-16-19-27(29)20-17-25/h16-17,19-20,23-24,26H,5-15,18,21-22H2,1-4H3/t23?,24-,26?,28-/m1/s1
InChIKey ZRFYEWUIRRWZAV-TWPJSWCISA-N
Molecular Weight 433.696 g/mol
SMILES ON1[C@](CC[C@]1(C)[H])(C(CCC(c1ccc(cc1)F)C)CCCCCCCCCCC)C
SPLASH splash10-0a4r-0590100000-e1c2dddea7e10f9e9f6e
Source of Spectrum O-25-70-25
Synonyms 2'-(p-fluorophenyl)-5'-hexadecadecyl-2,5-dimethylpyrrolidine-N-oxyl
Wiley ID 1382496