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4-Hexadecynoic acid, 2-phenoxy-, methyl ester
SpectraBase Compound ID 1PkigtOvpiW
InChI InChI=1S/C23H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-22(23(24)25-2)26-21-18-15-14-16-19-21/h14-16,18-19,22H,3-12,20H2,1-2H3
InChIKey ACRNSKUGJYVJKI-UHFFFAOYSA-N
Mol Weight 358.5 g/mol
Molecular Formula C23H34O3
Exact Mass 358.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECYwm21IMh
Name 4-Hexadecynoic acid, 2-phenoxy-, methyl ester
Alternate Name(s) Methyl 2-phenoxy-4-hexadecynoate 2-Phenoxy-4-hexadecynoic acid methyl ester 2-Phenoxyhexadec-4-ynoic acid methyl ester Methyl 2-phenoxyhexadec-4-ynoate
CAS Registry Number 40924-22-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H34O3
InChI InChI=1S/C23H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-17-20-22(23(24)25-2)26-21-18-15-14-16-19-21/h14-16,18-19,22H,3-12,20H2,1-2H3
InChIKey ACRNSKUGJYVJKI-UHFFFAOYSA-N
Molecular Weight 358.522 g/mol
SMILES CCCCCCCCCCCC#CCC(C(=O)OC)Oc1ccccc1
SPLASH splash10-0f6t-6961000000-67b42fd663c0b5299667
Source of Spectrum N-3-122-7
Wiley ID 1347394