SpectraBase Compound ID | JdpxVNlb5DP |
---|---|
InChI | InChI=1S/C11H13NO/c1-3-8-12-11(13)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3,(H,12,13) |
InChIKey | NKPIOFCIOMRALO-UHFFFAOYSA-N |
Mol Weight | 175.23 g/mol |
Molecular Formula | C11H13NO |
Exact Mass | 175.099714 g/mol |
SpectraBase Spectrum ID | CO0o9jifVvv |
---|---|
Name | Benzamide, 4-methyl-N-2-propenyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 175.099714042 u |
Formula | C11H13NO |
InChI | InChI=1S/C11H13NO/c1-3-8-12-11(13)10-6-4-9(2)5-7-10/h3-7H,1,8H2,2H3,(H,12,13) |
InChIKey | NKPIOFCIOMRALO-UHFFFAOYSA-N |
Molecular Weight | 175.231 g/mol |
SMILES | C(C1=CC=C(C=C1)C)(=O)NCC=C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.913559 |