SpectraBase Compound ID | DV3917lkdsr |
---|---|
InChI | InChI=1S/C10H15BrO3/c1-10(2,3)14-9(12)8(11)7-5-4-6-13-7/h4-6H2,1-3H3/b8-7- |
InChIKey | CJMLFTHMJRPYPT-FPLPWBNLSA-N |
Mol Weight | 263.13 g/mol |
Molecular Formula | C10H15BrO3 |
Exact Mass | 262.020457 g/mol |
SpectraBase Spectrum ID | 4aEPt0AB4zW |
---|---|
Name | 2-[T-Butoxycarbonyl(bromo)methylene]-tetrahydrofuran |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 262.020457340 u |
Formula | C10H15BrO3 |
InChI | InChI=1S/C10H15BrO3/c1-10(2,3)14-9(12)8(11)7-5-4-6-13-7/h4-6H2,1-3H3/b8-7- |
InChIKey | CJMLFTHMJRPYPT-FPLPWBNLSA-N |
SMILES | C(\C(=C/1OCCC1)Br)(OC(C)(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969888 |