SpectraBase Compound ID | HB7T4nWRmiV |
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InChI | InChI=1S/C11H11NO3/c1-7(13)6-12-10(14)8-4-2-3-5-9(8)11(12)15/h2-5,7,13H,6H2,1H3 |
InChIKey | XCQKPHDATCXMAA-UHFFFAOYSA-N |
Mol Weight | 205.21 g/mol |
Molecular Formula | C11H11NO3 |
Exact Mass | 205.073893 g/mol |
SpectraBase Spectrum ID | 8OvNpA7Nx8v |
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Name | N-(2-Hydroxypropyl)phthalimide |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 205.073893215 u |
Formula | C11H11NO3 |
InChI | InChI=1S/C11H11NO3/c1-7(13)6-12-10(14)8-4-2-3-5-9(8)11(12)15/h2-5,7,13H,6H2,1H3 |
InChIKey | XCQKPHDATCXMAA-UHFFFAOYSA-N |
Molecular Weight | 205.213 g/mol |
SMILES | C1=CC=2C(N(C(C2C=C1)=O)CC(C)O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915233 |