Methyl (2S)-4-(3-fluorobenzoyl)-1-(phenylsulfonyl)-2-piperazinecarboxylate

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Systematic / IUPAC Name: Methyl (2S)-1-(benzenesulfonyl)-4-(3-fluorobenzoyl)piperazine-2-carboxylate

ID: Reference12326

Other Names: NAT9-308260

Formula: C19H19FN2O5S

Spectral Data

Methyl (2S)-4-(3-fluorobenzoyl)-1-(phenylsulfonyl)-2-piperazinecarboxylate 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 1100
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/3/2023 8:35:12 AM
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Identificators

InChI InChI=1S/C19H19FN2O5S/c1-27-19(24)17-13-21(18(23)14-6-5-7-15(20)12-14)10-11-22(17)28(25,26)16-8-3-2-4-9-16/h2-9,12,17H,10-11,13H2,1H3/t17-/m0/s1
InChI Key CASYKONRQYAOAQ-KRWDZBQOSA-N
Canonical SMILES COC(=O)C1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)F
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Other Names NAT9-308260

In Other Databases

ChemSpider 5500280
PubChem 7161596