SpectraBase Compound ID | 9YZihOKidEM |
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InChI | InChI=1S/C11H13BrClNO/c1-3-8(12)11(15)14-10-7(2)5-4-6-9(10)13/h4-6,8H,3H2,1-2H3,(H,14,15) |
InChIKey | XJNXEWLGGWKBPT-UHFFFAOYSA-N |
Mol Weight | 290.59 g/mol |
Molecular Formula | C11H13BrClNO |
Exact Mass | 288.986905 g/mol |
SpectraBase Spectrum ID | I2vNBN8lwMM |
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Name | 2-Bromo-6'-chloro-o-butyrotoluidide |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 288.986904742 u |
Formula | C11H13BrClNO |
InChI | InChI=1S/C11H13BrClNO/c1-3-8(12)11(15)14-10-7(2)5-4-6-9(10)13/h4-6,8H,3H2,1-2H3,(H,14,15) |
InChIKey | XJNXEWLGGWKBPT-UHFFFAOYSA-N |
Molecular Weight | 290.588 g/mol |
SMILES | N(C1=C(C=CC=C1Cl)C)C(C(CC)Br)=O |