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3-Octanone, 2-hydroxy-2-methyl-4-[(phenylmethyl)amino]-

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3-Octanone, 2-hydroxy-2-methyl-4-[(phenylmethyl)amino]-
SpectraBase Compound ID 46SB6CYA83d
InChI InChI=1S/C16H25NO2/c1-4-5-11-14(15(18)16(2,3)19)17-12-13-9-7-6-8-10-13/h6-10,14,17,19H,4-5,11-12H2,1-3H3
InChIKey INDJUQKCAKEMBA-UHFFFAOYSA-N
Mol Weight 263.38 g/mol
Molecular Formula C16H25NO2
Exact Mass 263.188529 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AuqmCxuoBbr
Name 3-Octanone, 2-hydroxy-2-methyl-4-[(phenylmethyl)amino]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 263.188529047 u
Formula C16H25NO2
InChI InChI=1S/C16H25NO2/c1-4-5-11-14(15(18)16(2,3)19)17-12-13-9-7-6-8-10-13/h6-10,14,17,19H,4-5,11-12H2,1-3H3
InChIKey INDJUQKCAKEMBA-UHFFFAOYSA-N
Molecular Weight 263.381 g/mol
SMILES C(C(O)(C)C)(=O)C(NCC=1C=CC=CC1)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92516