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Adamantane-1-carboxamide, N-(2-pentyl)-N-decyl-
SpectraBase Compound ID GK7aJtkSb1f
InChI InChI=1S/C26H47NO/c1-4-6-7-8-9-10-11-12-14-27(21(3)13-5-2)25(28)26-18-22-15-23(19-26)17-24(16-22)20-26/h21-24H,4-20H2,1-3H3/t21?,22-,23+,24-,26-
InChIKey FZAVXLDIFPXDGF-QJVUDHKOSA-N
Mol Weight 389.7 g/mol
Molecular Formula C26H47NO
Exact Mass 389.365765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1gDZdoBywx0
Name Adamantane-1-carboxamide, N-(2-pentyl)-N-decyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.365765136 u
Formula C26H47NO
InChI InChI=1S/C26H47NO/c1-4-6-7-8-9-10-11-12-14-27(21(3)13-5-2)25(28)26-18-22-15-23(19-26)17-24(16-22)20-26/h21-24H,4-20H2,1-3H3/t21?,22-,23+,24-,26-
InChIKey FZAVXLDIFPXDGF-QJVUDHKOSA-N
Molecular Weight 389.668 g/mol
SMILES C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(N(C(C)CCC)CCCCCCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94131