(4S,6S)-N-[2-(Dimethylamino)ethyl]-6-isobutyl-1-(4-pyridinylmethyl)-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxamide

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

ID: Reference11635

Other Names: NAT33-501055

Formula: C26H35N5O

Spectral Data

(4S,6S)-N-[2-(Dimethylamino)ethyl]-6-isobutyl-1-(4-pyridinylmethyl)-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 3308
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/8/2022 10:21:29 AM
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Identificators

InChI InChI=1S/C26H35N5O/c1-18(2)14-22-21-6-5-7-24-25(21)20(17-31(24)16-19-8-10-27-11-9-19)15-23(29-22)26(32)28-12-13-30(3)4/h5-11,17-18,22-23,29H,12-16H2,1-4H3,(H,28,32)/t22-,23-/m0/s1
InChI Key ICXPOMTUNMDLDB-GOTSBHOMSA-N
Canonical SMILES CC(C)CC1C2=C3C(=CN(C3=CC=C2)CC4=CC=NC=C4)CC(N1)C(=O)NCCN(C)C
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Other Names NAT33-501055

In Other Databases

ChemSpider 29850979
PubChem 51138043