Nmr Spectrum to Structure Inference

About this skill

Use when you have 1D NMR spectra (1H or 13C or both) for an unknown organic compound with ≤19 heavy atoms and need to rapidly predict its molecular formula and connectivity graph without manual peak interpretation or exhaustive combinatorial search.

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0 potential findings · Scanned 11/4/2026 · Scanner 0.2.1

Content SHA-256: 4caa6883bf6801d7074ea1024c827aa5fb87782a68404b540d74237fcf94df03

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Original listing metadata

Original name

nmr-spectrum-to-structure-inference

Original description

Use when you have 1D NMR spectra (¹H or ¹³C or both) for an unknown organic compound with ≤19 heavy atoms and need to rapidly predict its molecular formula and connectivity graph without manual peak interpretation or exhaustive combinatorial search.

About this listing

Category: Science & research
Reported license: Apache-2.0
Listing language (estimated): English
Review status: Not individually reviewed
Agent compatibility: Atlas installation supports Claude Code, Codex, and Cursor. Skill-specific dependencies and features are checked during setup.