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(+/-) 2,3,4,9-Tetrahydro-1-(2-nitrophenyl)-1H-pyrido[3,4-b]-indole
SpectraBase Compound ID 58PFZXKRQgu
InChI InChI=1S/C17H15N3O2/c21-20(22)15-8-4-2-6-13(15)16-17-12(9-10-18-16)11-5-1-3-7-14(11)19-17/h1-8,16,18-19H,9-10H2
InChIKey LRCOEXUORPUHJK-UHFFFAOYSA-N
Mol Weight 293.33 g/mol
Molecular Formula C17H15N3O2
Exact Mass 293.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID XMNLc7EThY
Name 1-(2-nitrophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Carrier Gas Helium (1 ml/min)
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Exact Mass 293.116426733 u
Formula C17H15N3O2
GC Column HP-5ms (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 300oC
InChI InChI=1S/C17H15N3O2/c21-20(22)15-8-4-2-6-13(15)16-17-12(9-10-18-16)11-5-1-3-7-14(11)19-17/h1-8,16,18-19H,9-10H2
InChIKey LRCOEXUORPUHJK-UHFFFAOYSA-N
Inlet Type Split (90:1)
Instrument Name Agilent 7890A GC-5975C MSD
Ionization Type EI
Literature Reference DOI 10.1002/cbic.202300170
Molecular Weight 293.326 g/mol
Quality 756
SMILES N1CCC2=C(C1C1=C([N+](=O)[O-])C=CC=C1)NC1=C2C=CC=C1
SPLASH splash10-0a4i-0290000000-021075035a3b2e09a1a3
Source of Spectrum CBC-24-SM46-15g (DOI: 10.1002/cbic.202300170)
Wiley ID 1909995