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2,5-Cyclohexadiene-1,4-dione, 5-(butylamino)-2-hydroxy-3-undecyl-
SpectraBase Compound ID Hwd4gCyzdkv
InChI InChI=1S/C21H35NO3/c1-3-5-7-8-9-10-11-12-13-14-17-20(24)18(22-15-6-4-2)16-19(23)21(17)25/h16,22,25H,3-15H2,1-2H3
InChIKey HTIPVHNTEDTOCS-UHFFFAOYSA-N
Mol Weight 349.5 g/mol
Molecular Formula C21H35NO3
Exact Mass 349.261694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8NHyaHJOFZ
Name 2,5-Cyclohexadiene-1,4-dione, 5-(butylamino)-2-hydroxy-3-undecyl-
CAS Registry Number 56005-22-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H35NO3
InChI InChI=1S/C21H35NO3/c1-3-5-7-8-9-10-11-12-13-14-17-20(24)18(22-15-6-4-2)16-19(23)21(17)25/h16,22,25H,3-15H2,1-2H3
InChIKey HTIPVHNTEDTOCS-UHFFFAOYSA-N
Molecular Weight 349.515 g/mol
SMILES N(C=1C(C(=C(C(C1)=O)O)CCCCCCCCCCC)=O)CCCC
SPLASH splash10-0a4j-0689000000-aa1b17d203dd38aa6698
Source of Spectrum W5-0-0-0
Synonyms 5-(butylamino)-2-hydroxy-3-undecylbenzo-1,4-quinone
Wiley ID 1341472