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(Z,S-CIS)-1-AMINO-4,4-DIMETHYLPENT-1-EN-3-ONE

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(Z,S-CIS)-1-AMINO-4,4-DIMETHYLPENT-1-EN-3-ONE
SpectraBase Compound ID G7qli6ZuS0s
InChI InChI=1S/C7H13NO/c1-7(2,3)6(9)4-5-8/h4-5H,8H2,1-3H3/b5-4-
InChIKey MRXNCIATCXLDCN-PLNGDYQASA-N
Mol Weight 127.19 g/mol
Molecular Formula C7H13NO
Exact Mass 127.099714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1gtqOpOmp3t
Name 1-Amino-4,4-dimethyl-1-penten-3-one
CAS Registry Number 50874-59-4
Comments CIS-CONFIGURATION
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C7H13NO
InChI InChI=1S/C7H13NO/c1-7(2,3)6(9)4-5-8/h4-5H,8H2,1-3H3/b5-4-
InChIKey MRXNCIATCXLDCN-PLNGDYQASA-N
Instrument Name Jeol 4H-100
Literature Reference L. Kozerski, J. Dabrowski, Org. Magn. Resonance 5, 459 (1973).
NMR Standard Cyclohexane
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid