| SpectraBase Spectrum ID |
KpnA4c2Itly |
| Name |
(1E,3S)-1-Bromo-3-[(2-methoxyethoxy)methoxy]-1-butene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.020457340 u |
| Formula |
C8H15BrO3 |
| InChI |
InChI=1S/C8H15BrO3/c1-8(3-4-9)12-7-11-6-5-10-2/h3-4,8H,5-7H2,1-2H3/b4-3+/t8-/m0/s1 |
| InChIKey |
QKOBRDNAOYPVFX-RTMURIBGSA-N |
| Molecular Weight |
239.109 g/mol |
| SMILES |
[C@@](\C=C\Br)(OCOCCOC)(C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856965 |
![(1E,3S)-1-bromo-3-[(2-methoxyethoxy)methoxy]-1-butene](/api/spectrum/KpnA4c2Itly/structure.png?h=300&w=458 "(1E,3S)-1-bromo-3-[(2-methoxyethoxy)methoxy]-1-butene")
