SpectraBase Compound ID | I83vof1ghRH |
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InChI | InChI=1S/C19H26N2/c1-3-13-11-21-9-8-19-15-6-4-5-7-16(15)20-18(19)12(2)14(13)10-17(19)21/h4-7,12-14,17-18,20H,3,8-11H2,1-2H3/t12-,13-,14-,17+,18+,19-/m1/s1 |
InChIKey | KNZUAMRYQXIWSR-RUAUHYFQSA-N |
Mol Weight | 282.43 g/mol |
Molecular Formula | C19H26N2 |
Exact Mass | 282.209599 g/mol |
SpectraBase Spectrum ID | 8lYnaWU8IMF |
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Name | Curan |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 282.209598845 u |
Formula | C19H26N2 |
InChI | InChI=1S/C19H26N2/c1-3-13-11-21-9-8-19-15-6-4-5-7-16(15)20-18(19)12(2)14(13)10-17(19)21/h4-7,12-14,17-18,20H,3,8-11H2,1-2H3/t12-,13-,14-,17+,18+,19-/m1/s1 |
InChIKey | KNZUAMRYQXIWSR-RUAUHYFQSA-N |
SMILES | [C@@]12(N3C[C@]([C@@]([C@]([C@]4([C@@]2(C=2C(N4)=CC=CC2)CC3)[H])(C)[H])(C1)[H])(CC)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.847015 |