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

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

ID: Reference11039

Other Names: NAT11-284291

Formula: C26H26N2O3

Spectral Data

(1R,9S)-5-(2-Methylphenyl)-11-(phenoxyacetyl)-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 2
No. of Spectra 3068
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/19/2021 11:40:45 AM
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Identificators

InChI InChI=1S/C26H26N2O3/c1-18-7-5-6-10-22(18)23-11-12-24-20-13-19(15-28(24)26(23)30)14-27(16-20)25(29)17-31-21-8-3-2-4-9-21/h2-12,19-20H,13-17H2,1H3/t19-,20+/m0/s1
InChI Key UNNIKQYDXCWUFD-VQTJNVASSA-N
Canonical SMILES CC1=CC=CC=C1C2=CC=C3C4CC(CN(C4)C(=O)COC5=CC=CC=C5)CN3C2=O
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Other Names NAT11-284291

In Other Databases

ChemSpider 10116017
PubChem 11941698