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2-Cyclohexen-1-one, 2-[1-(butylamino)-2-methylpropyl]-3-hydroxy-5,5-dimethyl-
SpectraBase Compound ID 3sUgqfxhxg3
InChI InChI=1S/C16H29NO2/c1-7-11(2)17-16(5,6)8-12-13(18)9-15(3,4)10-14(12)19/h11,17-18H,7-10H2,1-6H3
InChIKey PZLXUYSHFNBRBW-UHFFFAOYSA-N
Mol Weight 267.41 g/mol
Molecular Formula C16H29NO2
Exact Mass 267.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EsOrVp0UOz
Name 2-Cyclohexen-1-one, 2-[1-(butylamino)-2-methylpropyl]-3-hydroxy-5,5-dimethyl-
CAS Registry Number 83814-49-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H29NO2
InChI InChI=1S/C16H29NO2/c1-7-11(2)17-16(5,6)8-12-13(18)9-15(3,4)10-14(12)19/h11,17-18H,7-10H2,1-6H3
InChIKey PZLXUYSHFNBRBW-UHFFFAOYSA-N
Molecular Weight 267.413 g/mol
SMILES OC1=C(CC(NC(CC)C)(C)C)C(CC(C1)(C)C)=O
SPLASH splash10-004l-1900000000-571ee7320329bbf59753
Source of Spectrum B-35-1427-0
Synonyms 2-(2-Butylamino-2-methyl)propyl-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one 2-[2-(sec-butylamino)-2-methylpropyl]-3-hydroxy-5,5-dimethyl-2-cyclohexen-1-one
Wiley ID 1271286