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Undec-10-ynoic acid, pentadecyl ester
SpectraBase Compound ID 6lMlWNjvm3u
InChI InChI=1S/C26H48O2/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-28-26(27)24-22-20-18-12-10-8-6-4-2/h2H,3,5-25H2,1H3
InChIKey UYXZZLUOPYJUTI-UHFFFAOYSA-N
Mol Weight 392.7 g/mol
Molecular Formula C26H48O2
Exact Mass 392.365431 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HiGJaitAHfV
Name Undec-10-ynoic acid, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 392.365430784 u
Formula C26H48O2
InChI InChI=1S/C26H48O2/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-28-26(27)24-22-20-18-12-10-8-6-4-2/h2H,3,5-25H2,1H3
InChIKey UYXZZLUOPYJUTI-UHFFFAOYSA-N
Molecular Weight 392.668 g/mol
SMILES C(CCCC(OCCCCCCCCCCCCCCC)=O)CCCCC#C