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2-Cyano-2-(3,5-di-tert-butyl-4-hydroxybenzyl)cyclopentanone
SpectraBase Compound ID 7g89wq9qZ7z
InChI InChI=1S/C21H29NO2/c1-19(2,3)15-10-14(11-16(18(15)24)20(4,5)6)12-21(13-22)9-7-8-17(21)23/h10-11,24H,7-9,12H2,1-6H3
InChIKey JWDNOVXZIXQLMA-UHFFFAOYSA-N
Mol Weight 327.47 g/mol
Molecular Formula C21H29NO2
Exact Mass 327.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mK1PPHwiH4
Name 2-Cyano-2-(3,5-di-tert-butyl-4-hydroxybenzyl)cyclopentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO2
InChI InChI=1S/C21H29NO2/c1-19(2,3)15-10-14(11-16(18(15)24)20(4,5)6)12-21(13-22)9-7-8-17(21)23/h10-11,24H,7-9,12H2,1-6H3
InChIKey JWDNOVXZIXQLMA-UHFFFAOYSA-N
Molecular Weight 327.468 g/mol
SMILES Oc1c(C(C)(C)C)cc(cc1C(C)(C)C)CC1(C#N)C(=O)CCC1
SPLASH splash10-014i-1092000000-89ab300e99648ade43e3
Source of Spectrum IC-942-0-0
Synonyms 1-(3,5-ditert-butyl-4-hydroxybenzyl)-2-oxocyclopentanecarbonitrile
Wiley ID 1325732