SpectraBase Compound ID | 99GqOOJ9tfO |
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InChI | InChI=1S/C14H16O2/c1-2-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16/h8-11H,2-5H2,1H3,(H,15,16) |
InChIKey | MXTSZHAMRQENQA-UHFFFAOYSA-N |
Mol Weight | 216.28 g/mol |
Molecular Formula | C14H16O2 |
Exact Mass | 216.11503 g/mol |
SpectraBase Spectrum ID | CTqpAxb4C8L |
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Name | 4-Hept-1-ynylbenzoic acid |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C14H16O2 |
InChI | InChI=1S/C14H16O2/c1-2-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16/h8-11H,2-5H2,1H3,(H,15,16) |
InChIKey | MXTSZHAMRQENQA-UHFFFAOYSA-N |
Molecular Weight | 216.280 g/mol |
SMILES | OC(c1ccc(C#CCCCCC)cc1)=O |
SPLASH | splash10-00p0-0910000000-8eff5b5b85a0f33235df |
Source of Spectrum | CV-0-175-0 |
Wiley ID | 849269 |