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4-Hexadecynoic acid, 2-(phenylmethoxy)-, methyl ester
SpectraBase Compound ID JDzzyQHSSpq
InChI InChI=1S/C24H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-23(24(25)26-2)27-21-22-18-15-14-16-19-22/h14-16,18-19,23H,3-12,20-21H2,1-2H3
InChIKey HJISZRRIUDDEAI-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C24H36O3
Exact Mass 372.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CD2PPkjReZz
Name 4-Hexadecynoic acid, 2-(phenylmethoxy)-, methyl ester
CAS Registry Number 40924-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36O3
InChI InChI=1S/C24H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-23(24(25)26-2)27-21-22-18-15-14-16-19-22/h14-16,18-19,23H,3-12,20-21H2,1-2H3
InChIKey HJISZRRIUDDEAI-UHFFFAOYSA-N
Molecular Weight 372.549 g/mol
SMILES CCCCCCCCCCCC#CCC(C(=O)OC)OCc1ccccc1
SPLASH splash10-00kf-7950000000-45e15379e8a76fa9e438
Source of Spectrum N-3-122-5
Synonyms 2-Benzoxyhexadec-4-ynoic acid methyl ester 2-Phenylmethoxy-4-hexadecynoic acid methyl ester Methyl 2-(benzyloxy)-4-hexadecynoate Methyl 2-benzyloxyhexadec-4-ynoate Methyl 2-phenylmethoxyhexadec-4-ynoate
Wiley ID 1355816