![Ethyl (trans)-4-[4'-o-acetyl-.alpha.-L-rhamnosyloxy)-3H-benzyl]carbamate](/api/spectrum/6Wpes458KVN/structure.png?h=300&w=458 "Ethyl (trans)-4-[4'-o-acetyl-.alpha.-L-rhamnosyloxy)-3H-benzyl]carbamate")
| SpectraBase Compound ID | IC4kj8y7GuL |
|---|---|
| InChI | InChI=1S/C18H25NO8/c1-4-24-18(23)19-9-12-5-7-13(8-6-12)27-17-15(22)14(21)16(10(2)25-17)26-11(3)20/h5-8,10,14-17,21-22H,4,9H2,1-3H3,(H,19,23)/t10?,14-,15?,16+,17-/m0/s1 |
| InChIKey | VMTHKXYSTHHGCH-HYRWUDOCSA-N |
| Mol Weight | 383.4 g/mol |
| Molecular Formula | C18H25NO8 |
| Exact Mass | 383.158017 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6Wpes458KVN |
|---|---|
| Name | Ethyl (trans)-4-[4'-o-acetyl-.alpha.-L-rhamnosyloxy)-3H-benzyl]carbamate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 383.158016761 u |
| Formula | C18H25NO8 |
| InChI | InChI=1S/C18H25NO8/c1-4-24-18(23)19-9-12-5-7-13(8-6-12)27-17-15(22)14(21)16(10(2)25-17)26-11(3)20/h5-8,10,14-17,21-22H,4,9H2,1-3H3,(H,19,23)/t10?,14-,15?,16+,17-/m0/s1 |
| InChIKey | VMTHKXYSTHHGCH-HYRWUDOCSA-N |
| Molecular Weight | 383.397 g/mol |
| SMILES | [C@]1(C([C@](O)([C@@](C(O1)C)(OC(=O)C)[H])[H])O)(OC=1C=CC(CNC(=O)OCC)=CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914965 |