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2-Undecyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid decyl ester
SpectraBase Compound ID BJkh15xd00V
InChI InChI=1S/C31H52O3/c1-3-5-7-9-11-13-14-16-18-20-29-23-21-27-26-28(22-24-30(27)34-29)31(32)33-25-19-17-15-12-10-8-6-4-2/h22,24,26,29H,3-21,23,25H2,1-2H3
InChIKey SNJIAPDNABUCFY-UHFFFAOYSA-N
Mol Weight 472.8 g/mol
Molecular Formula C31H52O3
Exact Mass 472.391646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ds1uAwyLVqx
Name 2-Undecyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid decyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H52O3
InChI InChI=1S/C31H52O3/c1-3-5-7-9-11-13-14-16-18-20-29-23-21-27-26-28(22-24-30(27)34-29)31(32)33-25-19-17-15-12-10-8-6-4-2/h22,24,26,29H,3-21,23,25H2,1-2H3
InChIKey SNJIAPDNABUCFY-UHFFFAOYSA-N
Molecular Weight 472.754 g/mol
SMILES c12OC(CCc2cc(C(=O)OCCCCCCCCCC)cc1)CCCCCCCCCCC
SPLASH splash10-00di-0002900000-bcf46c85c6836559d575
Source of Spectrum J-59-5935-7
Synonyms 2-Undecylchroman-6-carboxylic acid decyl ester decyl 2-undecyl-3,4-dihydro-2H-chromene-6-carboxylate decyl 2-undecylchromane-6-carboxylate
Wiley ID 1393541