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(Benzylmethylamino)tetrolaldehyde, diethyl acetal
SpectraBase Compound ID Gfl1WPcNM0b
InChI InChI=1S/C16H23NO2/c1-4-18-16(19-5-2)12-9-13-17(3)14-15-10-7-6-8-11-15/h6-8,10-11,16H,4-5,13-14H2,1-3H3
InChIKey RUFNFWJJLNJAHK-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID EpdRNdvRB59
Name (Benzylmethylamino)tetrolaldehyde, diethyl acetal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 261.172878983 u
Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-4-18-16(19-5-2)12-9-13-17(3)14-15-10-7-6-8-11-15/h6-8,10-11,16H,4-5,13-14H2,1-3H3
InChIKey RUFNFWJJLNJAHK-UHFFFAOYSA-N
Molecular Weight 261.365 g/mol
SMILES C=1C(=CC=CC1)CN(CC#CC(OCC)OCC)C
Spectrum/Structure Validation Score (Raman) 0.944261