2-[(3S)-1-(2-Pyridinylmethyl)-3-pyrrolidinyl]-1,3-benzothiazole

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Systematic / IUPAC Name: 2-[(3S)-1-(Pyridin-2-ylmethyl)pyrrolidin-3-yl]-1,3-benzothiazole

ID: Reference9705

Other Names: Benzothiazole, 2-[(3S)-1-(2-pyridinylmethyl)-3-pyrrolidinyl]-;
NAT31-456987

Formula: C17H17N3S

Spectral Data

2-[(3S)-1-(2-Pyridinylmethyl)-3-pyrrolidinyl]-1,3-benzothiazole 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 450
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 5/22/2020 10:12:29 AM
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Identificators

InChI InChI=1S/C17H17N3S/c1-2-7-16-15(6-1)19-17(21-16)13-8-10-20(11-13)12-14-5-3-4-9-18-14/h1-7,9,13H,8,10-12H2/t13-/m0/s1
InChI Key MFJWGYFVAFNPDF-ZDUSSCGKSA-N
Canonical SMILES C1CN(CC1C2=NC3=CC=CC=C3S2)CC4=CC=CC=N4
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Other Names Benzothiazole, 2-[(3S)-1-(2-pyridinylmethyl)-3-pyrrolidinyl]-;
NAT31-456987

In Other Databases

PubChem 51137085
ChemSpider 29849986