(1R,9S)-3-(2-Thienyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

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Systematic / IUPAC Name: (1R,9S)-3-Thiophen-2-yl-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference8859

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-11-(2-thienyl)-, (1R,5S)-;
NAT11-287773

Formula: C15H16N2OS

Spectral Data

(1R,9S)-3-(2-Thienyl)-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 FAIMS
No. of Spectral Trees 1
No. of Spectra 782
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 8/16/2019 7:21:26 AM
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Identificators

InChI InChI=1S/C15H16N2OS/c18-14-4-3-12(13-2-1-5-19-13)15-11-6-10(7-16-8-11)9-17(14)15/h1-5,10-11,16H,6-9H2/t10-,11+/m0/s1
InChI Key XSEHVHDBJGYDGF-WDEREUQCSA-N
Canonical SMILES C1C2CNCC1C3=C(C=CC(=O)N3C2)C4=CC=CS4
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-11-(2-thienyl)-, (1R,5S)-;
NAT11-287773

In Other Databases

ChemSpider 5997675
PubChem 7685286