(1R,9R)-5-(2-Thienyl)-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-Thiophen-2-yl-11-thiophen-2-ylsulfonyl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference10154

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-9-(2-thienyl)-3-(2-thienylsulfonyl)-, (1R,5R)-;
NAT11-284086

Formula: C19H18N2O3S3

Spectral Data

(1R,9R)-5-(2-Thienyl)-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 1900
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 12/18/2020 9:36:59 AM
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Identificators

InChI InChI=1S/C19H18N2O3S3/c22-19-15(17-3-1-7-25-17)5-6-16-14-9-13(11-21(16)19)10-20(12-14)27(23,24)18-4-2-8-26-18/h1-8,13-14H,9-12H2/t13-,14+/m0/s1
InChI Key ZOBYMSGQCKFBGD-UONOGXRCSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)C4=CC=CS4)S(=O)(=O)C5=CC=CS5
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-thienyl)-3-(2-thienylsulfonyl)-, (1R,5R)-;
NAT11-284086

In Other Databases

PubChem 11885189
ChemSpider 10059517