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3-Butenyl 3-(di-t-butylmethylene)-2-(p-nitrophenyl)thiirane-2-carboxylate
SpectraBase Compound ID 5cH2XxeNDm8
InChI InChI=1S/C22H29NO4S/c1-8-9-14-27-19(24)22(15-10-12-16(13-11-15)23(25)26)18(28-22)17(20(2,3)4)21(5,6)7/h8,10-13H,1,9,14H2,2-7H3
InChIKey WKSJQRFKZNOQBE-UHFFFAOYSA-N
Mol Weight 403.54 g/mol
Molecular Formula C22H29NO4S
Exact Mass 403.18173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5tQve5YfbYi
Name 3-Butenyl 3-(di-t-butylmethylene)-2-(p-nitrophenyl)thiirane-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H29NO4S
InChI InChI=1S/C22H29NO4S/c1-8-9-14-27-19(24)22(15-10-12-16(13-11-15)23(25)26)18(28-22)17(20(2,3)4)21(5,6)7/h8,10-13H,1,9,14H2,2-7H3
InChIKey WKSJQRFKZNOQBE-UHFFFAOYSA-N
Molecular Weight 403.537 g/mol
SMILES C1(C(=C(C(C)(C)C)C(C)(C)C)S1)(C(=O)OCCC=C)c1ccc(N(=O)=O)cc1
SPLASH splash10-0pb9-9002500000-f4d08b3d258af45b8ac4
Source of Spectrum AJ-68-1399-16
Synonyms 3-Butenyl 3-(1-tert-butyl-2,2-dimethylpropylidene)-2-(4-nitrophenyl)-2-thiiranecarboxylate
Wiley ID 773308