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2,6-Pyridinedicarboxylic acid, 3-methylbenzyl isobutyl ester
SpectraBase Compound ID FJHjtiwJiMm
InChI InChI=1S/C19H21NO4/c1-13(2)11-23-18(21)16-8-5-9-17(20-16)19(22)24-12-15-7-4-6-14(3)10-15/h4-10,13H,11-12H2,1-3H3
InChIKey HNCKAHATPXZQAM-UHFFFAOYSA-N
Mol Weight 327.38 g/mol
Molecular Formula C19H21NO4
Exact Mass 327.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AznnSwrZgti
Name 2,6-Pyridinedicarboxylic acid, 3-methylbenzyl isobutyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-13(2)11-23-18(21)16-8-5-9-17(20-16)19(22)24-12-15-7-4-6-14(3)10-15/h4-10,13H,11-12H2,1-3H3
InChIKey HNCKAHATPXZQAM-UHFFFAOYSA-N
Molecular Weight 327.380 g/mol
SMILES C(OC(c1nc(ccc1)C(OCc1cc(ccc1)C)=O)=O)C(C)C
SPLASH splash10-0adi-2900000000-d484e59692fe8e308269
Source of Spectrum TIPS-2023-957-0
Wiley ID 1885663