| SpectraBase Compound ID | KTY2pAKUl1S |
|---|---|
| InChI | InChI=1S/C18H37N/c1-4-6-8-10-12-14-18-16-15-17(19(18)3)13-11-9-7-5-2/h17-18H,4-16H2,1-3H3 |
| InChIKey | VCXVTMUHXPLXGB-UHFFFAOYSA-N |
| Mol Weight | 267.5 g/mol |
| Molecular Formula | C18H37N |
| Exact Mass | 267.2926 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9BS9cPYdS5e |
|---|---|
| Name | Pyrrolidine, 5-heptyl-2-hexyl-1-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.292600195 u |
| Formula | C18H37N |
| InChI | InChI=1S/C18H37N/c1-4-6-8-10-12-14-18-16-15-17(19(18)3)13-11-9-7-5-2/h17-18H,4-16H2,1-3H3 |
| InChIKey | VCXVTMUHXPLXGB-UHFFFAOYSA-N |
| Molecular Weight | 267.501 g/mol |
| SMILES | C1(N(C(CCCCCC)CC1)C)CCCCCCC |