(1R,9R)-5-(2-Naphthyl)-11-(2-thienylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

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Systematic / IUPAC Name: (1R,9R)-5-Naphthalen-2-yl-11-thiophen-2-ylsulfonyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference9727

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-9-(2-naphthalenyl)-3-(2-thienylsulfonyl)-, (1R,5R)-;
NAT11-283846

Formula: C25H22N2O3S2

Spectral Data

(1R,9R)-5-(2-Naphthyl)-11-(2-thienylsulfonyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-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 2200
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 5/29/2020 9:53:01 AM
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Identificators

InChI InChI=1S/C25H22N2O3S2/c28-25-22(20-8-7-18-4-1-2-5-19(18)13-20)9-10-23-21-12-17(15-27(23)25)14-26(16-21)32(29,30)24-6-3-11-31-24/h1-11,13,17,21H,12,14-16H2/t17-,21+/m0/s1
InChI Key UTWGXGHZCSFJBH-LAUBAEHRSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)C4=CC5=CC=CC=C5C=C4)S(=O)(=O)C6=CC=CS6
CAS
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Other Names 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-9-(2-naphthalenyl)-3-(2-thienylsulfonyl)-, (1R,5R)-;
NAT11-283846

In Other Databases

PubChem 11885156
ChemSpider 10059484