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1-(3-dodecyl-2-quinoxalinyl)-1-tridecanone
SpectraBase Compound ID KomAPiGQT0s
InChI InChI=1S/C33H54N2O/c1-3-5-7-9-11-13-15-17-19-21-27-31-33(35-30-26-24-23-25-29(30)34-31)32(36)28-22-20-18-16-14-12-10-8-6-4-2/h23-26H,3-22,27-28H2,1-2H3
InChIKey FTCAABSEXQFZIP-UHFFFAOYSA-N
Mol Weight 494.8 g/mol
Molecular Formula C33H54N2O
Exact Mass 494.423614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7EWQP9dTtJU
Name 1-(3-dodecyl-2-quinoxalinyl)-1-tridecanone
CAS Registry Number 66438-93-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H54N2O
InChI InChI=1S/C33H54N2O/c1-3-5-7-9-11-13-15-17-19-21-27-31-33(35-30-26-24-23-25-29(30)34-31)32(36)28-22-20-18-16-14-12-10-8-6-4-2/h23-26H,3-22,27-28H2,1-2H3
InChIKey FTCAABSEXQFZIP-UHFFFAOYSA-N
Molecular Weight 494.808 g/mol
SMILES c1(nc2c(nc1CCCCCCCCCCCC)cccc2)C(=O)CCCCCCCCCCCC
SPLASH splash10-0006-0039300000-a47b99081dc84602cc5e
Source of Spectrum K-111-1028-0
Synonyms 1-(3-dodecylquinoxalin-2-yl)tridecan-1-one 1-(3-laurylquinoxalin-2-yl)tridecan-1-one
Wiley ID 1398011