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PUUQDDMRHVFUDQ-BDAKNGLRSA-N

View entire compound with spectra: 1 NMR, and 1 MS (GC)

PUUQDDMRHVFUDQ-BDAKNGLRSA-N
SpectraBase Compound ID UJLnDfAxEE
InChI InChI=1S/C10H19NO/c1-7(2)9-5-4-8(3)6-10(12)11-9/h7-9H,4-6H2,1-3H3,(H,11,12)/t8-,9+/m1/s1
InChIKey PUUQDDMRHVFUDQ-BDAKNGLRSA-N
Mol Weight 169.27 g/mol
Molecular Formula C10H19NO
Exact Mass 169.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ARQGrkngPtX
Name 4-Methyl-7-propan-2-yl-2-azepanone
Alternate Name(s) 4-Methyl-7-propan-2-yl-azepan-2-one 7-isopropyl-4-methyl-azepan-2-one (4R,7S)-4-methyl-7-propan-2-yl-2-azepanone (4R,7S)-4-methyl-7-propan-2-ylazepan-2-one (4R,7S)-4-methyl-7-propan-2-yl-azepan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H19NO
InChI InChI=1S/C10H19NO/c1-7(2)9-5-4-8(3)6-10(12)11-9/h7-9H,4-6H2,1-3H3,(H,11,12)/t8-,9+/m1/s1
InChIKey PUUQDDMRHVFUDQ-BDAKNGLRSA-N
Molecular Weight 169.268 g/mol
SMILES N1[C@@](CC[C@](CC1=O)(C)[H])(C(C)C)[H]
SPLASH splash10-004i-6900000000-0dd5977617e2a5f8ea26
Source of Spectrum SK-22-279-2
Wiley ID 852015