(4S,6S)-N-(4-Fluorobenzyl)-6-isobutyl-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxamide

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Systematic / IUPAC Name: (9S,11S)-N-[(4-Fluorophenyl)methyl]-9-(2-methylpropyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-11-carboxamide

ID: Reference11905

Other Names: NAT33-474977

Formula: C23H26FN3O

Spectral Data

(4S,6S)-N-(4-Fluorobenzyl)-6-isobutyl-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxamide 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 2626
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/2/2022 9:22:22 AM
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Identificators

InChI InChI=1S/C23H26FN3O/c1-14(2)10-20-18-4-3-5-19-22(18)16(13-25-19)11-21(27-20)23(28)26-12-15-6-8-17(24)9-7-15/h3-9,13-14,20-21,25,27H,10-12H2,1-2H3,(H,26,28)/t20-,21-/m0/s1
InChI Key NIQNTRSPPORWBS-SFTDATJTSA-N
Canonical SMILES CC(C)CC1C2=C3C(=CNC3=CC=C2)CC(N1)C(=O)NCC4=CC=C(C=C4)F
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Other Names NAT33-474977

In Other Databases

ChemSpider 29850907
PubChem 51137958