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(7aR,13S)-13-Phenyl-8,9,10,11-tetrahydro-7aH,13H-naphtho[1,2-e]pyrido[2,1-b][1,3]oxazine

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(7aR,13S)-13-Phenyl-8,9,10,11-tetrahydro-7aH,13H-naphtho[1,2-e]pyrido[2,1-b][1,3]oxazine
SpectraBase Compound ID AgIM6aI0Pu9
InChI InChI=1S/C22H21NO/c1-2-9-17(10-3-1)22-21-18-11-5-4-8-16(18)13-14-19(21)24-20-12-6-7-15-23(20)22/h1-5,8-11,13-14,20,22H,6-7,12,15H2/t20-,22+/m1/s1
InChIKey NKTURDWYUWMOKB-IRLDBZIGSA-N
Mol Weight 315.42 g/mol
Molecular Formula C22H21NO
Exact Mass 315.162314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhQkoPS4vY1
Name (7ar,13S)-13-Phenyl-8,9,10,11-tetrahydro-7ah,13H-naphtho[1,2-E]pyrido[2,1-B][1,3]oxazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.162314299 u
Formula C22H21NO
InChI InChI=1S/C22H21NO/c1-2-9-17(10-3-1)22-21-18-11-5-4-8-16(18)13-14-19(21)24-20-12-6-7-15-23(20)22/h1-5,8-11,13-14,20,22H,6-7,12,15H2/t20-,22+/m1/s1
InChIKey NKTURDWYUWMOKB-IRLDBZIGSA-N
Molecular Weight 315.416 g/mol
SMILES C1=2[C@@](N3CCCC[C@]3(OC2C=CC2=C1C=CC=C2)[H])(C1=CC=CC=C1)[H]