| SpectraBase Compound ID | 7ixUfK0tnOw |
|---|---|
| InChI | InChI=1S/C14H17NO3.Na/c1-2-3-5-10-12(14(17)18)15-13(16)11-8-6-4-7-9-11;/h4,6-10H,2-3,5H2,1H3,(H,15,16)(H,17,18);/q;+1/p-1/b12-10+; |
| InChIKey | AQFKNTQWBPWZQM-VHPXAQPISA-M |
| Mol Weight | 269.27576928 g/mol |
| Molecular Formula | C14H16NNaO3 |
| Exact Mass | 269.102788 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 3BXexH4EzGH |
|---|---|
| Name | 2-Heptenoic acid, 2-(benzoylamino)-, monosodium salt |
| CAS Registry Number | 70685-60-8 |
| Copyright | Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C14H16NNaO3 |
| InChI | InChI=1S/C14H17NO3.Na/c1-2-3-5-10-12(14(17)18)15-13(16)11-8-6-4-7-9-11;/h4,6-10H,2-3,5H2,1H3,(H,15,16)(H,17,18);/q;+1/p-1/b12-10+; |
| InChIKey | AQFKNTQWBPWZQM-VHPXAQPISA-M |
| Instrument Name | Bruker IFS 85 |
| Technique | KBr-Pellet |