| SpectraBase Compound ID | ISDG1Uul0iT |
|---|---|
| InChI | InChI=1S/C14H24O3/c1-3-4-5-6-7-8-9-10-13(15)11-12-14(16)17-2/h13,15H,3-10H2,1-2H3 |
| InChIKey | LZYRBYMBNXWRAM-UHFFFAOYSA-N |
| Mol Weight | 240.34 g/mol |
| Molecular Formula | C14H24O3 |
| Exact Mass | 240.172545 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1Od6ksfba6v |
|---|---|
| Name | Methyl 4-hydroxytridec-2-ynoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.172544630 u |
| Formula | C14H24O3 |
| InChI | InChI=1S/C14H24O3/c1-3-4-5-6-7-8-9-10-13(15)11-12-14(16)17-2/h13,15H,3-10H2,1-2H3 |
| InChIKey | LZYRBYMBNXWRAM-UHFFFAOYSA-N |
| Molecular Weight | 240.343 g/mol |
| SMILES | C(C#CC(CCCCCCCCC)O)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921345 |