(8aS)-7-(Phenylsulfonyl)-2-(3-pyridinylmethyl)hexahydroimidazo[1,5-a]pyrazin-3(2H)-one

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Systematic / IUPAC Name: (8aS)-7-(Benzenesulfonyl)-2-(pyridin-3-ylmethyl)-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one

ID: Reference11706

Other Names: NAT50-554828

Formula: C18H20N4O3S

Spectral Data

(8aS)-7-(Phenylsulfonyl)-2-(3-pyridinylmethyl)hexahydroimidazo[1,5-a]pyrazin-3(2H)-one mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 463
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 9/6/2022 9:05:24 AM
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Identificators

InChI InChI=1S/C18H20N4O3S/c23-18-20(12-15-5-4-8-19-11-15)13-16-14-21(9-10-22(16)18)26(24,25)17-6-2-1-3-7-17/h1-8,11,16H,9-10,12-14H2/t16-/m0/s1
InChI Key UUBWITHGAYVHJC-INIZCTEOSA-N
Canonical SMILES C1CN2C(CN1S(=O)(=O)C3=CC=CC=C3)CN(C2=O)CC4=CN=CC=C4
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Other Names NAT50-554828

In Other Databases

ChemSpider 29856062
PubChem 75536974
ChEMBL CHEMBL3437160