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Benzeneethanamine 3-benzyloxy-.alpha.,4-dihydroxy-

View entire compound with spectra: 1 FTIR

Benzeneethanamine 3-benzyloxy-.alpha.,4-dihydroxy-
SpectraBase Compound ID 2R4qi4dVKk2
InChI InChI=1S/C10H15NO3/c1-2-14-10-5-7(9(13)6-11)3-4-8(10)12/h3-5,9,12-13H,2,6,11H2,1H3
InChIKey PKHCCYSUTPFTMT-UHFFFAOYSA-N
Mol Weight 197.23 g/mol
Molecular Formula C10H15NO3
Exact Mass 197.105193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HNUlBkHJQsg
Name Benzeneethanamine 3-benzyloxy-.alpha.,4-dihydroxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 197.105193344 u
Formula C10H15NO3
InChI InChI=1S/C10H15NO3/c1-2-14-10-5-7(9(13)6-11)3-4-8(10)12/h3-5,9,12-13H,2,6,11H2,1H3
InChIKey PKHCCYSUTPFTMT-UHFFFAOYSA-N
Molecular Weight 197.234 g/mol
SMILES C1=C(C=C(C(=C1)O)OCC)C(CN)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928794