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2-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenyl cyclohexanecarboxylate

View entire compound with spectra: 2 NMR

2-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenyl cyclohexanecarboxylate
SpectraBase Compound ID 1fi4AdldArP
InChI InChI=1S/C20H21N3O2/c1-14-11-12-19(25-20(24)15-7-3-2-4-8-15)18(13-14)23-21-16-9-5-6-10-17(16)22-23/h5-6,9-13,15H,2-4,7-8H2,1H3
InChIKey CZSPULXDAVGHQX-UHFFFAOYSA-N
Mol Weight 335.41 g/mol
Molecular Formula C20H21N3O2
Exact Mass 335.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 15ttKq6Zfb4
Name 2-(2H-1,2,3-Benzotriazol-2-yl)-4-methylphenyl cyclohexanecarboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.163376926 u
Formula C20H21N3O2
InChI InChI=1S/C20H21N3O2/c1-14-11-12-19(25-20(24)15-7-3-2-4-8-15)18(13-14)23-21-16-9-5-6-10-17(16)22-23/h5-6,9-13,15H,2-4,7-8H2,1H3
InChIKey CZSPULXDAVGHQX-UHFFFAOYSA-N
Molecular Weight 335.407 g/mol
SMILES C(OC1=C(C=C(C=C1)C)N1N=C2C(=N1)C=CC=C2)(=O)C1CCCCC1