2-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chloro-1,3-benzoxazole

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Systematic / IUPAC Name: 2-[(3S)-1-Benzylpyrrolidin-3-yl]-5-chloro-1,3-benzoxazole

ID: Reference10981

Other Names: NAT31-456660

Formula: C18H17ClN2O

Spectral Data

2-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chloro-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 704
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/28/2021 5:52:14 PM
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Identificators

InChI InChI=1S/C18H17ClN2O/c19-15-6-7-17-16(10-15)20-18(22-17)14-8-9-21(12-14)11-13-4-2-1-3-5-13/h1-7,10,14H,8-9,11-12H2/t14-/m0/s1
InChI Key NACRNZGTZKVXLQ-AWEZNQCLSA-N
Canonical SMILES C1CN(CC1C2=NC3=C(O2)C=CC(=C3)Cl)CC4=CC=CC=C4
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Other Names NAT31-456660

In Other Databases

ChemSpider 29849902
PubChem 45784085