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

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

ID: Reference11736

Other Names: NAT50-554830

Formula: C13H18N4O3S

Spectral Data

(8aS)-7-(Methylsulfonyl)-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.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 499
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 9/8/2022 8:18:36 AM
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Identificators

InChI InChI=1S/C13H18N4O3S/c1-21(19,20)16-5-6-17-12(10-16)9-15(13(17)18)8-11-3-2-4-14-7-11/h2-4,7,12H,5-6,8-10H2,1H3/t12-/m0/s1
InChI Key NAYHHSUGONVNHN-LBPRGKRZSA-N
Canonical SMILES CS(=O)(=O)N1CCN2C(C1)CN(C2=O)CC3=CN=CC=C3
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Other Names NAT50-554830

In Other Databases

ChemSpider 29856063
PubChem 75536975