5-Chloro-2-[(3S)-1-(3-methoxybenzyl)-3-pyrrolidinyl]-1,3-benzoxazole

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Systematic / IUPAC Name: 5-Chloro-2-[(3S)-1-[(3-methoxyphenyl)methyl]pyrrolidin-3-yl]-1,3-benzoxazole

ID: Reference10973

Other Names: NAT31-456686

Formula: C19H19ClN2O2

Spectral Data

5-Chloro-2-[(3S)-1-(3-methoxybenzyl)-3-pyrrolidinyl]-1,3-benzoxazole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 700
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/22/2021 11:38:17 AM
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Identificators

InChI InChI=1S/C19H19ClN2O2/c1-23-16-4-2-3-13(9-16)11-22-8-7-14(12-22)19-21-17-10-15(20)5-6-18(17)24-19/h2-6,9-10,14H,7-8,11-12H2,1H3/t14-/m0/s1
InChI Key WKRPSRIYXLZWCT-AWEZNQCLSA-N
Canonical SMILES COC1=CC=CC(=C1)CN2CCC(C2)C3=NC4=C(O3)C=CC(=C4)Cl
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Other Names NAT31-456686

In Other Databases

PubChem 45784177
ChemSpider 29849911