N-[(1R,9S)-11-(Cyclohexylmethyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-4-methylbenzenesulfonamide

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Systematic / IUPAC Name: N-[(1R,9S)-11-(Cyclohexylmethyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-4-methylbenzenesulfonamide

ID: Reference12279

Other Names: NAT11-275458

Formula: C25H33N3O3S

Spectral Data

N-[(1R,9S)-11-(Cyclohexylmethyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-4-methylbenzenesulfonamide 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 1693
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/20/2023 12:08:04 PM
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Identificators

InChI InChI=1S/C25H33N3O3S/c1-18-7-9-22(10-8-18)32(30,31)26-23-11-12-24-21-13-20(16-28(24)25(23)29)15-27(17-21)14-19-5-3-2-4-6-19/h7-12,19-21,26H,2-6,13-17H2,1H3/t20-,21+/m0/s1
InChI Key FOSNRRCLDPBEPS-LEWJYISDSA-N
Canonical SMILES CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C3C4CC(CN(C4)CC5CCCCC5)CN3C2=O
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Other Names NAT11-275458

In Other Databases

PubChem 40467553
ChemSpider 21380061