SpectraBase Compound ID | BiHqDlFZFWX |
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InChI | InChI=1S/C7H14N2O2/c1-6(10)7(11)9-5-3-4-8-2/h8H,3-5H2,1-2H3,(H,9,11) |
InChIKey | QNZMUJAHJMCZOV-UHFFFAOYSA-N |
Mol Weight | 158.2 g/mol |
Molecular Formula | C7H14N2O2 |
Exact Mass | 158.105528 g/mol |
SpectraBase Spectrum ID | 4pVccNkWTFo |
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Name | Polyamide-3,2 |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 158.105527697 u |
Formula | C7H14N2O2 |
InChI | InChI=1S/C7H14N2O2/c1-6(10)7(11)9-5-3-4-8-2/h8H,3-5H2,1-2H3,(H,9,11) |
InChIKey | QNZMUJAHJMCZOV-UHFFFAOYSA-N |
Molecular Weight | 158.201 g/mol |
Nominal Mass | 158 u |
SMILES | N(C)CCCNC(C(C)=O)=O |
Spectrum/Structure Validation Score (Raman) | 0.994401 |