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1-Pyrrolidinyloxy, 5-(5-carboxypentyl)-3-hexyl-2,2,5-trimethyl-, trans-
SpectraBase Compound ID 7tf4DiCQOZ3
InChI InChI=1S/C19H36NO3/c1-5-6-7-9-12-16-15-19(4,20(23)18(16,2)3)14-11-8-10-13-17(21)22/h16H,5-15H2,1-4H3,(H,21,22)/t16-,19+/m1/s1
InChIKey ZQGITUYTQYNULR-APWZRJJASA-N
Mol Weight 327.5 g/mol
Molecular Formula C19H37NO3
Exact Mass 327.277344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9EvDLfNbZR
Name 1-Pyrrolidinyloxy, 5-(5-carboxypentyl)-3-hexyl-2,2,5-trimethyl-, trans-
CAS Registry Number 107643-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36NO3
InChI InChI=1S/C19H36NO3/c1-5-6-7-9-12-16-15-19(4,20(23)18(16,2)3)14-11-8-10-13-17(21)22/h16H,5-15H2,1-4H3,(H,21,22)/t16-,19+/m1/s1
InChIKey ZQGITUYTQYNULR-APWZRJJASA-N
Molecular Weight 327.509 g/mol
SMILES OC(CCCCC[C@]1(C[C@](C(N1O)(C)C)(CCCCCC)[H])C)=O
SPLASH splash10-03di-0094000000-913e038894fff74bb444
Source of Spectrum KC-1986-1435-0
Synonyms 6-(1,3,3-Trimethyl-4-hexyl-pyrrolidin-2-oxyl)-hexanoic acid
Wiley ID 1324918