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(2S)-1-methyl-2-(2-methylpropyl)-5,6-dihydro-2H-azepin-7-one
SpectraBase Compound ID 88T6LlYQPT5
InChI InChI=1S/C11H19NO/c1-9(2)8-10-6-4-5-7-11(13)12(10)3/h4,6,9-10H,5,7-8H2,1-3H3/t10-/m1/s1
InChIKey ILVZHIWFTXORQO-SNVBAGLBSA-N
Mol Weight 181.28 g/mol
Molecular Formula C11H19NO
Exact Mass 181.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUVwSVvFmXC
Name (2S)-1-methyl-2-(2-methylpropyl)-5,6-dihydro-2H-azepin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H19NO
InChI InChI=1S/C11H19NO/c1-9(2)8-10-6-4-5-7-11(13)12(10)3/h4,6,9-10H,5,7-8H2,1-3H3/t10-/m1/s1
InChIKey ILVZHIWFTXORQO-SNVBAGLBSA-N
Molecular Weight 181.279 g/mol
SMILES C1(N([C@](C=CCC1)(CC(C)C)[H])C)=O
SPLASH splash10-01b9-9600000000-c43d10aa9a83639d0787
Source of Spectrum KC-0-3406-30
Synonyms (2S)-2-isobutyl-1-methyl-5,6-dihydro-2H-azepin-7-one
Wiley ID 782787