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4-(N-Tritylamino)-1-phenylbutanol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

4-(N-Tritylamino)-1-phenylbutanol
SpectraBase Compound ID 3g6o5gdvelT
InChI InChI=1S/C29H29NO/c31-28(24-14-5-1-6-15-24)22-13-23-30-29(25-16-7-2-8-17-25,26-18-9-3-10-19-26)27-20-11-4-12-21-27/h1-12,14-21,28,30-31H,13,22-23H2/t28-/m0/s1
InChIKey BTFGITMFCOTBFF-NDEPHWFRSA-N
Mol Weight 407.56 g/mol
Molecular Formula C29H29NO
Exact Mass 407.224915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID C3Go4muCYfr
Name 4-(N-Tritylamino)-1-phenylbutanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.224914557 u
Formula C29H29NO
InChI InChI=1S/C29H29NO/c31-28(24-14-5-1-6-15-24)22-13-23-30-29(25-16-7-2-8-17-25,26-18-9-3-10-19-26)27-20-11-4-12-21-27/h1-12,14-21,28,30-31H,13,22-23H2/t28-/m0/s1
InChIKey BTFGITMFCOTBFF-NDEPHWFRSA-N
Molecular Weight 407.557 g/mol
SMILES C(C=1C=CC=CC1)(C1=CC=CC=C1)(C=1C=CC=CC1)NCCC[C@@](C=1C=CC=CC1)(O)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.802451