(1R,9S)-11-Benzoyl-5-[(E)-2-(4-chlorophenyl)vinyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

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Systematic / IUPAC Name: (1R,9S)-11-Benzoyl-5-[(E)-2-(4-chlorophenyl)ethenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

ID: Reference10002

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-benzoyl-9-[(E)-2-(4-chlorophenyl)ethenyl]-1,2,3,4,5,6-hexahydro-, (1R,5S)-;
NAT11-285417

Formula: C26H23ClN2O2

Spectral Data

(1R,9S)-11-Benzoyl-5-[(E)-2-(4-chlorophenyl)vinyl]-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 275
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 10/23/2020 8:38:42 AM
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Identificators

InChI InChI=1S/C26H23ClN2O2/c27-23-11-7-18(8-12-23)6-9-21-10-13-24-22-14-19(16-29(24)26(21)31)15-28(17-22)25(30)20-4-2-1-3-5-20/h1-13,19,22H,14-17H2/b9-6+/t19-,22+/m0/s1
InChI Key UXJWNNAHPGEQAO-ZORGVRQLSA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)C=CC4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5
CAS
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Other Names 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-benzoyl-9-[(E)-2-(4-chlorophenyl)ethenyl]-1,2,3,4,5,6-hexahydro-, (1R,5S)-;
NAT11-285417

In Other Databases

ChemSpider 5977653
PubChem 7663744