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Methyl (1R,3S)-1-methyl-2-(2,2,2-trifluoroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate
SpectraBase Compound ID CI78zvw3HcO
InChI InChI=1S/C16H15F3N2O3/c1-8-13-10(9-5-3-4-6-11(9)20-13)7-12(14(22)24-2)21(8)15(23)16(17,18)19/h3-6,8,12,20H,7H2,1-2H3/t8-,12+/m1/s1
InChIKey ZXXLDOWJDATRKB-PELKAZGASA-N
Mol Weight 340.3 g/mol
Molecular Formula C16H15F3N2O3
Exact Mass 340.103477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWAG2xBp3xM
Name Methyl (1R,3S)-1-methyl-2-(2,2,2-trifluoroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15F3N2O3
InChI InChI=1S/C16H15F3N2O3/c1-8-13-10(9-5-3-4-6-11(9)20-13)7-12(14(22)24-2)21(8)15(23)16(17,18)19/h3-6,8,12,20H,7H2,1-2H3/t8-,12+/m1/s1
InChIKey ZXXLDOWJDATRKB-PELKAZGASA-N
Instrument Name HP G1800A GCD or VG 12-250
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19970422)11_7_762
Molecular Weight 340.302 g/mol
SMILES [nH]1c2c(c3C[C@](N([C@@](c13)(C)[H])C(=O)C(F)(F)F)(C(=O)OC)[H])cccc2
SPLASH splash10-014l-1941000000-c595cc5658021d5c7930
Source of Spectrum RCM-11-765-3i-a
Wiley ID 1837591