SpectraBase Compound ID | 8XDfHXW8GDH |
---|---|
InChI | InChI=1S/C9H17Br/c1-2-3-4-5-6-7-8-9-10/h4-5H,2-3,6-9H2,1H3/b5-4- |
InChIKey | JZVFNKUHFQSRHK-PLNGDYQASA-N |
Mol Weight | 205.14 g/mol |
Molecular Formula | C9H17Br |
Exact Mass | 204.051364 g/mol |
SpectraBase Spectrum ID | AEPmSR4ToMJ |
---|---|
Name | 1-Bromo-5-nonene, (Z)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 204.051363547 u |
Formula | C9H17Br |
InChI | InChI=1S/C9H17Br/c1-2-3-4-5-6-7-8-9-10/h4-5H,2-3,6-9H2,1H3/b5-4- |
InChIKey | JZVFNKUHFQSRHK-PLNGDYQASA-N |
Molecular Weight | 205.139 g/mol |
SMILES | C(Br)CCC\C=C/CCC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968667 |