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(4S)-(3'-Oxo-6'-phenylhex-1'(E)-enyl)-2,2-dimethyloxazolidine-3-carboxylic acid tert-butyl ester
SpectraBase Compound ID KWe21yiTTZM
InChI InChI=1S/C22H31NO4/c1-21(2,3)27-20(25)23-18(16-26-22(23,4)5)14-15-19(24)13-9-12-17-10-7-6-8-11-17/h6-8,10-11,14-15,18H,9,12-13,16H2,1-5H3/b15-14+/t18-/m0/s1
InChIKey NSNZWEXXYSMYFP-JJJPLKNQSA-N
Mol Weight 373.49 g/mol
Molecular Formula C22H31NO4
Exact Mass 373.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qh5SKWyW36
Name (4S)-(3'-Oxo-6'-phenylhex-1'(E)-enyl)-2,2-dimethyloxazolidine-3-carboxylic acid tert-butyl ester
Alternate Name(s) tert-Butyl (4S)-2,2-dimethyl-4-[(1E)-3-oxo-6-phenyl-1-hexenyl]-1,3-oxazolidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO4
InChI InChI=1S/C22H31NO4/c1-21(2,3)27-20(25)23-18(16-26-22(23,4)5)14-15-19(24)13-9-12-17-10-7-6-8-11-17/h6-8,10-11,14-15,18H,9,12-13,16H2,1-5H3/b15-14+/t18-/m0/s1
InChIKey NSNZWEXXYSMYFP-JJJPLKNQSA-N
Molecular Weight 373.493 g/mol
SMILES C(N1C(OC[C@@]1(\C=C\C(=O)CCCc1ccccc1)[H])(C)C)(OC(C)(C)C)=O
SPLASH splash10-0udi-0940000000-e9eb03d817464883002c
Source of Spectrum QA-47-95-3
Wiley ID 863307