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trans-1-(4-Methoxyphenyl)-3-phenoxy-4-methyl-4-(4-nitrophenylmethyl)thio-azetidin-2-one
SpectraBase Compound ID H03kz2LxYGp
InChI InChI=1S/C24H22N2O5S/c1-24(32-16-17-8-10-19(11-9-17)26(28)29)22(31-21-6-4-3-5-7-21)23(27)25(24)18-12-14-20(30-2)15-13-18/h3-15,22H,16H2,1-2H3/t22-,24+/m0/s1
InChIKey AJPFYAFNSPUIRN-LADGPHEKSA-N
Mol Weight 450.51 g/mol
Molecular Formula C24H22N2O5S
Exact Mass 450.124943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9s4zvrYBzrN
Name trans-1-(4-Methoxyphenyl)-3-phenoxy-4-methyl-4-(4-nitrophenylmethyl)thio-azetidin-2-one
Alternate Name(s) (3S,4R)-1-(4-methoxyphenyl)-4-methyl-4-[(4-nitrobenzyl)sulfanyl]-3-phenoxy-2-azetidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N2O5S
InChI InChI=1S/C24H22N2O5S/c1-24(32-16-17-8-10-19(11-9-17)26(28)29)22(31-21-6-4-3-5-7-21)23(27)25(24)18-12-14-20(30-2)15-13-18/h3-15,22H,16H2,1-2H3/t22-,24+/m0/s1
InChIKey AJPFYAFNSPUIRN-LADGPHEKSA-N
Molecular Weight 450.509 g/mol
SMILES [C@]1(N(c2ccc(cc2)OC)C([C@@]1(Oc1ccccc1)[H])=O)(SCc1ccc(N(=O)=O)cc1)C
SPLASH splash10-0udi-0709100000-a3b1b5b87c80547dafe1
Source of Spectrum F-47-6765-5
Wiley ID 1387657