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exo-2-(Benzoyloxy)-8,8-dimethyl-1-azabicyclo[3.2.1]octane
SpectraBase Compound ID 21wR0o6R5vw
InChI InChI=1S/C16H21NO2/c1-16(2)13-8-9-14(17(16)11-10-13)19-15(18)12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3
InChIKey KCUXGCMNDGCQHG-UHFFFAOYSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AkRVyvEqc7W
Name exo-2-(Benzoyloxy)-8,8-dimethyl-1-azabicyclo[3.2.1]octane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 259.157228918 u
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-16(2)13-8-9-14(17(16)11-10-13)19-15(18)12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3
InChIKey KCUXGCMNDGCQHG-UHFFFAOYSA-N
Molecular Weight 259.349 g/mol
SMILES C1(N2C(C(CC1)CC2)(C)C)OC(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.819264