(1R,9S)-11-(1-Acetyl-4-piperidinyl)-5-[2-(4-morpholinylmethyl)phenyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

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

ID: Reference10075

Other Names: 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-(1-acetyl-4-piperidinyl)-1,2,3,4,5,6-hexahydro-9-[2-(4-morpholinylmethyl)phenyl]-, (1R,5S)-;
NAT11-304100

Formula: C29H38N4O3

Spectral Data

(1R,9S)-11-(1-Acetyl-4-piperidinyl)-5-[2-(4-morpholinylmethyl)phenyl]-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 1471
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 11/19/2020 10:23:29 AM
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Identificators

InChI InChI=1S/C29H38N4O3/c1-21(34)31-10-8-25(9-11-31)32-17-22-16-24(20-32)28-7-6-27(29(35)33(28)18-22)26-5-3-2-4-23(26)19-30-12-14-36-15-13-30/h2-7,22,24-25H,8-20H2,1H3/t22-,24+/m0/s1
InChI Key WLGRGOGJTIXJGZ-LADGPHEKSA-N
Canonical SMILES CC(=O)N1CCC(CC1)N2CC3CC(C2)C4=CC=C(C(=O)N4C3)C5=CC=CC=C5CN6CCOCC6
CAS
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Other Names 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-(1-acetyl-4-piperidinyl)-1,2,3,4,5,6-hexahydro-9-[2-(4-morpholinylmethyl)phenyl]-, (1R,5S)-;
NAT11-304100

In Other Databases

ChemSpider 7705759
PubChem 9420609