SpectraBase Compound ID | 9X691u9NSLj |
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InChI | InChI=1S/C10H15N3/c1-2-4-12-10(3-1)9-11-5-6-13-7-8-13/h1-4,11H,5-9H2 |
InChIKey | LLMKBJFLWNURHN-UHFFFAOYSA-N |
Mol Weight | 177.25 g/mol |
Molecular Formula | C10H15N3 |
Exact Mass | 177.126597 g/mol |
SpectraBase Spectrum ID | 4vRJqWj12mL |
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Name | N-[2-[[2-Pyridylmethyl]amino]ethyl]aziridine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 177.126597495 u |
Formula | C10H15N3 |
InChI | InChI=1S/C10H15N3/c1-2-4-12-10(3-1)9-11-5-6-13-7-8-13/h1-4,11H,5-9H2 |
InChIKey | LLMKBJFLWNURHN-UHFFFAOYSA-N |
Molecular Weight | 177.251 g/mol |
SMILES | C1=CC=CN=C1CNCCN1CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961529 |