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Methyl 2-methoxycarbonyl-8-phenyloct-7-ynoate
SpectraBase Compound ID GShd5EKM0fO
InChI InChI=1S/C17H20O4/c1-20-16(18)15(17(19)21-2)13-9-4-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12,15H,3-4,9,13H2,1-2H3
InChIKey XILQUVBZJSTJFB-UHFFFAOYSA-N
Mol Weight 288.34 g/mol
Molecular Formula C17H20O4
Exact Mass 288.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IQrWVSoKgNl
Name Methyl 2-methoxycarbonyl-8-phenyloct-7-ynoate
Alternate Name(s) Dimethyl 2-(6-phenyl-5-hexynyl)malonate
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Formula C17H20O4
InChI InChI=1S/C17H20O4/c1-20-16(18)15(17(19)21-2)13-9-4-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12,15H,3-4,9,13H2,1-2H3
InChIKey XILQUVBZJSTJFB-UHFFFAOYSA-N
Molecular Weight 288.343 g/mol
SMILES C(C(=O)OC)(C(=O)OC)CCCCC#Cc1ccccc1
SPLASH splash10-015c-1910000000-daaadb6cda89a499a796
Source of Spectrum F-47-6303-11
Wiley ID 1291840