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(-)-(4S)-2-[(5R,6S)-5-Allyl-6-phenylcyclohexa-1,3-dienyl]-4-isopropyl-4,5-dihydrooxazole
SpectraBase Compound ID 99OtPaMwlpe
InChI InChI=1S/C21H25NO/c1-4-9-16-12-8-13-18(20(16)17-10-6-5-7-11-17)21-22-19(14-23-21)15(2)3/h4-8,10-13,15-16,19-20H,1,9,14H2,2-3H3/t16-,19-,20+/m1/s1
InChIKey KIKYFUIGSXADPQ-AHRSYUTCSA-N
Mol Weight 307.44 g/mol
Molecular Formula C21H25NO
Exact Mass 307.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1GXjxKPAXJ
Name (-)-(4S)-2-[(5R,6S)-5-Allyl-6-phenylcyclohexa-1,3-dienyl]-4-isopropyl-4,5-dihydrooxazole
Alternate Name(s) (4S)-2-[(5R,6S)-5-allyl-6-phenyl-1,3-cyclohexadien-1-yl]-4-isopropyl-4,5-dihydro-1,3-oxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO
InChI InChI=1S/C21H25NO/c1-4-9-16-12-8-13-18(20(16)17-10-6-5-7-11-17)21-22-19(14-23-21)15(2)3/h4-8,10-13,15-16,19-20H,1,9,14H2,2-3H3/t16-,19-,20+/m1/s1
InChIKey KIKYFUIGSXADPQ-AHRSYUTCSA-N
Molecular Weight 307.437 g/mol
SMILES C1(=N[C@@](C(C)C)(CO1)[H])C=1[C@@]([C@](CC=C)(C=CC1)[H])(c1ccccc1)[H]
SPLASH splash10-014i-1590000000-354874e1b9923fb28bb7
Source of Spectrum SO-0-2048-13
Wiley ID 878848