SpectraBase Compound ID | BIjXTSHJL4v |
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InChI | InChI=1S/C8H14BrNO/c1-7(2)8(9)10-3-5-11-6-4-10/h8H,1,3-6H2,2H3 |
InChIKey | PIQCNGQRMXUHFF-UHFFFAOYSA-N |
Mol Weight | 220.11 g/mol |
Molecular Formula | C8H14BrNO |
Exact Mass | 219.025877 g/mol |
SpectraBase Spectrum ID | K1jwZgrDu1M |
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Name | N-[1'-Bromo-2'-methyl-2'-propen-1'-yl]morpholine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 219.025877074 u |
Formula | C8H14BrNO |
InChI | InChI=1S/C8H14BrNO/c1-7(2)8(9)10-3-5-11-6-4-10/h8H,1,3-6H2,2H3 |
InChIKey | PIQCNGQRMXUHFF-UHFFFAOYSA-N |
Molecular Weight | 220.110 g/mol |
SMILES | C(N1CCOCC1)(C(=C)C)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958336 |