SpectraBase Compound ID | DsVzmSXyshz |
---|---|
InChI | InChI=1S/C11H13N/c1-10(2)8-12-9-11-6-4-3-5-7-11/h3-7,9H,1,8H2,2H3/b12-9+ |
InChIKey | CWUPKNDZADQYIO-FMIVXFBMSA-N |
Mol Weight | 159.23 g/mol |
Molecular Formula | C11H13N |
Exact Mass | 159.104799 g/mol |
SpectraBase Spectrum ID | LwdBg7mUbb5 |
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Name | N-(Benzylidene)-2-methyl-2-propenylamine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 159.104799423 u |
Formula | C11H13N |
InChI | InChI=1S/C11H13N/c1-10(2)8-12-9-11-6-4-3-5-7-11/h3-7,9H,1,8H2,2H3/b12-9+ |
InChIKey | CWUPKNDZADQYIO-FMIVXFBMSA-N |
Molecular Weight | 159.232 g/mol |
SMILES | C=1(\C=N\CC(=C)C)C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975478 |