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(-)-(4S)-4-tert-Butyl-2-[(5R,6S)-5-allyl-6-phenylcyclohexa-1,3-dienyl]-4,5-dihydrooxazole
SpectraBase Compound ID 7sEEw4LQSM5
InChI InChI=1S/C22H27NO/c1-5-10-16-13-9-14-18(20(16)17-11-7-6-8-12-17)21-23-19(15-24-21)22(2,3)4/h5-9,11-14,16,19-20H,1,10,15H2,2-4H3/t16-,19-,20+/m1/s1
InChIKey JMDOKCOJRARFQE-AHRSYUTCSA-N
Mol Weight 321.46 g/mol
Molecular Formula C22H27NO
Exact Mass 321.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4BD2zLTXac
Name (-)-(4S)-4-tert-Butyl-2-[(5R,6S)-5-allyl-6-phenylcyclohexa-1,3-dienyl]-4,5-dihydrooxazole
Alternate Name(s) (4S)-2-[(5R,6S)-5-allyl-6-phenyl-1,3-cyclohexadien-1-yl]-4-tert-butyl-4,5-dihydro-1,3-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO
InChI InChI=1S/C22H27NO/c1-5-10-16-13-9-14-18(20(16)17-11-7-6-8-12-17)21-23-19(15-24-21)22(2,3)4/h5-9,11-14,16,19-20H,1,10,15H2,2-4H3/t16-,19-,20+/m1/s1
InChIKey JMDOKCOJRARFQE-AHRSYUTCSA-N
Molecular Weight 321.464 g/mol
SMILES C1(=N[C@@](C(C)(C)C)(CO1)[H])C=1[C@@]([C@](CC=C)(C=CC1)[H])(c1ccccc1)[H]
SPLASH splash10-01q9-0190000000-665ea4748dfb5973ea3f
Source of Spectrum SO-0-2049-19
Wiley ID 878841