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N-Benzyl-N-(2'-iodobenzoyl)-3,3,5,5-tetramethyl-1-aminocyclohexene
SpectraBase Compound ID IBuGcvTIcpl
InChI InChI=1S/C24H28INO/c1-23(2)14-19(15-24(3,4)17-23)26(16-18-10-6-5-7-11-18)22(27)20-12-8-9-13-21(20)25/h5-14H,15-17H2,1-4H3
InChIKey PQTLICCNTHWRGY-UHFFFAOYSA-N
Mol Weight 473.4 g/mol
Molecular Formula C24H28INO
Exact Mass 473.12156 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36Siayw9rJx
Name N-Benzyl-N-(2'-iodobenzoyl)-3,3,5,5-tetramethyl-1-aminocyclohexene
Alternate Name(s) N-benzyl-2-iodo-N-(3,3,5,5-tetramethyl-1-cyclohexen-1-yl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28INO
InChI InChI=1S/C24H28INO/c1-23(2)14-19(15-24(3,4)17-23)26(16-18-10-6-5-7-11-18)22(27)20-12-8-9-13-21(20)25/h5-14H,15-17H2,1-4H3
InChIKey PQTLICCNTHWRGY-UHFFFAOYSA-N
Molecular Weight 473.398 g/mol
SMILES C(N(C1=CC(C)(C)CC(C1)(C)C)Cc1ccccc1)(c1c(I)cccc1)=O
SPLASH splash10-05ai-1070900000-b3c33f7ae04c2cdf4fa1
Source of Spectrum F-48-7310-14
Wiley ID 1393625