[(4S,6S)-6-Isobutyl-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indol-4-yl](4-morpholinyl)methanone

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Systematic / IUPAC Name: [(9S,11S)-9-(2-Methylpropyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-11-yl]-morpholin-4-ylmethanone

ID: Reference10079

Other Names: Methanone, 4-morpholinyl[(4S,6S)-3,4,5,6-tetrahydro-6-(2-methylpropyl)-1H-azepino[5,4,3-cd]indol-4-yl]-;
NAT33-474987

Formula: C20H27N3O2

Spectral Data

[(4S,6S)-6-Isobutyl-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indol-4-yl](4-morpholinyl)methanone 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 3251
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 11/19/2020 10:06:45 AM
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Identificators

InChI InChI=1S/C20H27N3O2/c1-13(2)10-17-15-4-3-5-16-19(15)14(12-21-16)11-18(22-17)20(24)23-6-8-25-9-7-23/h3-5,12-13,17-18,21-22H,6-11H2,1-2H3/t17-,18-/m0/s1
InChI Key SJWANCJQDNJPGS-ROUUACIJSA-N
Canonical SMILES CC(C)CC1C2=C3C(=CNC3=CC=C2)CC(N1)C(=O)N4CCOCC4
CAS
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Other Names Methanone, 4-morpholinyl[(4S,6S)-3,4,5,6-tetrahydro-6-(2-methylpropyl)-1H-azepino[5,4,3-cd]indol-4-yl]-;
NAT33-474987

In Other Databases

PubChem 51137966
ChemSpider 29850915