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(4S)-4-isopropyl-2-[6-[6-[(4S)-4-isopropyl-2-oxazolin-2-yl]-2-pyridyl]-2-pyridyl]-2-oxazoline
SpectraBase Compound ID FU7AXY0zHtT
InChI InChI=1S/C22H26N4O2/c1-13(2)19-11-27-21(25-19)17-9-5-7-15(23-17)16-8-6-10-18(24-16)22-26-20(12-28-22)14(3)4/h5-10,13-14,19-20H,11-12H2,1-4H3/t19-,20-/m1/s1
InChIKey NNCROLGXDLXLJM-WOJBJXKFSA-N
Mol Weight 378.48 g/mol
Molecular Formula C22H26N4O2
Exact Mass 378.205576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lnPoT3Tkm
Name (4S)-4-isopropyl-2-[6-[6-[(4S)-4-isopropyl-2-oxazolin-2-yl]-2-pyridyl]-2-pyridyl]-2-oxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N4O2
InChI InChI=1S/C22H26N4O2/c1-13(2)19-11-27-21(25-19)17-9-5-7-15(23-17)16-8-6-10-18(24-16)22-26-20(12-28-22)14(3)4/h5-10,13-14,19-20H,11-12H2,1-4H3/t19-,20-/m1/s1
InChIKey NNCROLGXDLXLJM-WOJBJXKFSA-N
Molecular Weight 378.476 g/mol
SMILES C1(=N[C@](CO1)(C(C)C)[H])c1nc(-c2nc(C3=N[C@@](C(C)C)(CO3)[H])ccc2)ccc1
SPLASH splash10-007c-0966000000-8e87a82711e45373b1fb
Source of Spectrum QC-4-149-1
Synonyms (4S)-4-isopropyl-2-[6-[6-[(4S)-4-isopropyl-4,5-dihydrooxazol-2-yl]-2-pyridyl]-2-pyridyl]-4,5-dihydrooxazole (4S)-4-propan-2-yl-2-[6-[6-[(4S)-4-propan-2-yl-4,5-dihydrooxazol-2-yl]-2-pyridinyl]-2-pyridinyl]-4,5-dihydrooxazole
Wiley ID 883220