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

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

ID: Reference9995

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 1,2,3,4,5,6-hexahydro-3-[2-(methylthio)acetyl]-9-(2-naphthalenyl)-, (1R,5S)-;
NAT11-283821

Formula: C24H24N2O2S

Spectral Data

(1R,9S)-11-[(Methylsulfanyl)acetyl]-5-(2-naphthyl)-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 1170
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 10/21/2020 12:15:22 PM
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Identificators

InChI InChI=1S/C24H24N2O2S/c1-29-15-23(27)25-12-16-10-20(14-25)22-9-8-21(24(28)26(22)13-16)19-7-6-17-4-2-3-5-18(17)11-19/h2-9,11,16,20H,10,12-15H2,1H3/t16-,20+/m0/s1
InChI Key YXZWNRDTKBPHMA-OXJNMPFZSA-N
Canonical SMILES CSCC(=O)N1CC2CC(C1)C3=CC=C(C(=O)N3C2)C4=CC5=CC=CC=C5C=C4
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-3-[2-(methylthio)acetyl]-9-(2-naphthalenyl)-, (1R,5S)-;
NAT11-283821

In Other Databases

PubChem 7143712
ChemSpider 5484675