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Pyrrolidine-2,2-D2, 1-[7-ethyl-3-methyl-1-oxo-9-(2,2,6-trimethylcyclohexyl)nonyl]-
SpectraBase Compound ID Li18k6GR7qB
InChI InChI=1S/C25H47NO/c1-6-22(14-15-23-21(3)12-10-16-25(23,4)5)13-9-11-20(2)19-24(27)26-17-7-8-18-26/h20-23H,6-19H2,1-5H3/i17D2
InChIKey LKALADWDNIECIQ-FBCWWBABSA-N
Mol Weight 379.7 g/mol
Molecular Formula C25H452D2NO
Exact Mass 379.378319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BadQT4ITCsu
Name Pyrrolidine-2,2-D2, 1-[7-ethyl-3-methyl-1-oxo-9-(2,2,6-trimethylcyclohexyl)nonyl]-
CAS Registry Number 55786-44-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H45D2NO
InChI InChI=1S/C25H47NO/c1-6-22(14-15-23-21(3)12-10-16-25(23,4)5)13-9-11-20(2)19-24(27)26-17-7-8-18-26/h20-23H,6-19H2,1-5H3/i17D2
InChIKey LKALADWDNIECIQ-FBCWWBABSA-N
Molecular Weight 379.669 g/mol
SMILES C(N1C(CCC1)([2D])[2D])(CC(CCCC(CCC1C(CCCC1C)(C)C)CC)C)=O
SPLASH splash10-014i-0923000000-769d72a36c81ab796f0e
Source of Spectrum AH-106-207-8
Synonyms 9-(2',2',6'-Trimethylcyclohexyl)-2,2-dideutero-3-methyl-7-ethyl-nonancarboxylic acid-pyrrolidide
Wiley ID 1358372