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(3R,12bR)-3-Methyl-2,3,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-4-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(3R,12bR)-3-Methyl-2,3,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-4-one
SpectraBase Compound ID LLOnWst2zSJ
InChI InChI=1S/C16H18N2O/c1-10-6-7-14-15-12(8-9-18(14)16(10)19)11-4-2-3-5-13(11)17-15/h2-5,10,14,17H,6-9H2,1H3/t10-,14-/m1/s1
InChIKey WIWWLKMBPGAJMB-QMTHXVAHSA-N
Mol Weight 254.33 g/mol
Molecular Formula C16H18N2O
Exact Mass 254.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AWCF44rpF4O
Name (3R,12Br)-3-methyl-2,3,6,7,12,12B-hexahydro-1H-indolo[2,3-A]quinolizin-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.141913207 u
Formula C16H18N2O
InChI InChI=1S/C16H18N2O/c1-10-6-7-14-15-12(8-9-18(14)16(10)19)11-4-2-3-5-13(11)17-15/h2-5,10,14,17H,6-9H2,1H3/t10-,14-/m1/s1
InChIKey WIWWLKMBPGAJMB-QMTHXVAHSA-N
Molecular Weight 254.333 g/mol
SMILES C12=C(C3=CC=CC=C3N2)CCN2[C@@]1(CC[C@](C)([H])C2=O)[H]