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2,6-Pyridinedicarboxylic acid, 5-methylhex-2-yl hexadecyl ester
SpectraBase Compound ID 2ysjuxPzegI
InChI InChI=1S/C30H51NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-34-29(32)27-20-19-21-28(31-27)30(33)35-26(4)23-22-25(2)3/h19-21,25-26H,5-18,22-24H2,1-4H3
InChIKey JCOJXFNRWXTUSA-UHFFFAOYSA-N
Mol Weight 489.7 g/mol
Molecular Formula C30H51NO4
Exact Mass 489.381809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLZRVob40Os
Name 2,6-Pyridinedicarboxylic acid, 5-methylhex-2-yl hexadecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H51NO4
InChI InChI=1S/C30H51NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-34-29(32)27-20-19-21-28(31-27)30(33)35-26(4)23-22-25(2)3/h19-21,25-26H,5-18,22-24H2,1-4H3
InChIKey JCOJXFNRWXTUSA-UHFFFAOYSA-N
Molecular Weight 489.741 g/mol
SMILES C(OC(c1nc(ccc1)C(OC(CCC(C)C)C)=O)=O)CCCCCCCCCCCCCCC
SPLASH splash10-0aou-7923000000-5f721b1bc4042c499871
Source of Spectrum TIPS-2023-937-0
Wiley ID 1885643