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1-Pyrrolidinyloxy, 2-(4-ethoxy-3-nitrophenyl)-5-hexadecyl-2,5-dimethyl-, trans-
SpectraBase Compound ID 9NkLXgNC2V6
InChI InChI=1S/C30H51N2O4/c1-6-8-9-10-11-12-13-14-15-16-27(30(5)22-21-25(4)31(30)33)19-17-24(3)26-18-20-29(36-7-2)28(23-26)32(34)35/h18,20,23-25,27H,6-17,19,21-22H2,1-5H3/t24?,25-,27?,30-/m1/s1
InChIKey UIODHNIDOORRQS-SFRGGMRFSA-N
Mol Weight 504.8 g/mol
Molecular Formula C30H52N2O4
Exact Mass 504.392708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvqWYTquwz9
Name 1-Pyrrolidinyloxy, 2-(4-ethoxy-3-nitrophenyl)-5-hexadecyl-2,5-dimethyl-, trans-
CAS Registry Number 127898-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H51N2O4
InChI InChI=1S/C30H51N2O4/c1-6-8-9-10-11-12-13-14-15-16-27(30(5)22-21-25(4)31(30)33)19-17-24(3)26-18-20-29(36-7-2)28(23-26)32(34)35/h18,20,23-25,27H,6-17,19,21-22H2,1-5H3/t24?,25-,27?,30-/m1/s1
InChIKey UIODHNIDOORRQS-SFRGGMRFSA-N
Molecular Weight 504.756 g/mol
SMILES ON1[C@@](C(CCC(c2cc(N(=O)=O)c(cc2)OCC)C)CCCCCCCCCCC)(CC[C@]1(C)[H])C
SPLASH splash10-004i-0090010000-56d63a2e684b5082914e
Source of Spectrum O-25-70-26
Synonyms 2'-(p-ethoxy-m-nitrophenyl)-5'-hexadecadecyl-2,5-dimethylpyrrolidine-N-oxyl
Wiley ID 1399420