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2-Pivaloyl-1,2,3,4-tetrahydroisoquinoline

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 1 MS (GC)

2-Pivaloyl-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID D2plWeegXny
InChI InChI=1S/C14H19NO/c1-14(2,3)13(16)15-9-8-11-6-4-5-7-12(11)10-15/h4-7H,8-10H2,1-3H3
InChIKey HWSYMHFJGZIIOP-UHFFFAOYSA-N
Mol Weight 217.31 g/mol
Molecular Formula C14H19NO
Exact Mass 217.146664 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID ChiD55fVYcH
Name 2-Pivaloyl-1,2,3,4-tetrahydroisoquinoline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 217.146664235 u
Formula C14H19NO
InChI InChI=1S/C14H19NO/c1-14(2,3)13(16)15-9-8-11-6-4-5-7-12(11)10-15/h4-7H,8-10H2,1-3H3
InChIKey HWSYMHFJGZIIOP-UHFFFAOYSA-N
Molecular Weight 217.312 g/mol
SMILES C=12C=CC=CC1CN(CC2)C(C(C)(C)C)=O
Spectrum/Structure Validation Score (Raman) 0.962035