Systematic / IUPAC Name: 1-[3-(1H-Indol-3-ylmethyl)-1,4-dioxo-3,6,7,8,9,9a-hexahydro-2H-pyrido[1,2-a]pyrazin-8-yl]triazole-4,5-dicarboxamide
ID: Reference9599
Other Names:
1H-1,2,3-Triazole-4,5-dicarboxamide, 1-[octahydro-3-(1H-indol-3-ylmethyl)-1,4-dioxo-2H-pyrido[1,2-a]pyrazin-8-yl]-;
NAT7-243197
Formula: C21H22N8O4
1-[3-(1H-Indol-3-ylmethyl)-1,4-dioxooctahydro-2H-pyrido[1,2-a]pyrazin-8-yl]-1H-1,2,3-triazole-4,5-dicarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 2 |
No. of Spectra | 4401 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6, MS7 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 4/15/2020 7:52:23 AM |
InChI | InChI=1S/C21H22N8O4/c22-18(30)16-17(19(23)31)29(27-26-16)11-5-6-28-15(8-11)20(32)25-14(21(28)33)7-10-9-24-13-4-2-1-3-12(10)13/h1-4,9,11,14-15,24H,5-8H2,(H2,22,30)(H2,23,31)(H,25,32) |
InChI Key | IJSZIMUCFBQRBK-UHFFFAOYSA-N |
Canonical SMILES | C1CN2C(CC1N3C(=C(N=N3)C(=O)N)C(=O)N)C(=O)NC(C2=O)CC4=CNC5=CC=CC=C54 |
CAS | |
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Other Names |
1H-1,2,3-Triazole-4,5-dicarboxamide, 1-[octahydro-3-(1H-indol-3-ylmethyl)-1,4-dioxo-2H-pyrido[1,2-a]pyrazin-8-yl]-; NAT7-243197 |