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Adamantane-1-carboxamide, N-benzyl-
SpectraBase Compound ID D8WPkzWMIqL
InChI InChI=1S/C18H23NO/c20-17(19-12-13-4-2-1-3-5-13)18-9-14-6-15(10-18)8-16(7-14)11-18/h1-5,14-16H,6-12H2,(H,19,20)/t14-,15+,16-,18-
InChIKey AEGPPEKTVKFZNH-CMIRHGDUSA-N
Mol Weight 269.39 g/mol
Molecular Formula C18H23NO
Exact Mass 269.177964 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2fxW4rK9Ite
Name Adamantane-1-carboxamide, N-benzyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 269.177964364 u
Formula C18H23NO
InChI InChI=1S/C18H23NO/c20-17(19-12-13-4-2-1-3-5-13)18-9-14-6-15(10-18)8-16(7-14)11-18/h1-5,14-16H,6-12H2,(H,19,20)/t14-,15+,16-,18-
InChIKey AEGPPEKTVKFZNH-CMIRHGDUSA-N
SMILES C12(C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])C(NCC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958419