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N-(2-Acetyl-1-cyclohexenyl)-L-isoleucine piperidide
SpectraBase Compound ID 55eEotz648Q
InChI InChI=1S/C19H32N2O2/c1-4-14(2)18(19(23)21-12-8-5-9-13-21)20-17-11-7-6-10-16(17)15(3)22/h14,18,20H,4-13H2,1-3H3/t14-,18-/m0/s1
InChIKey WTHKOOUTZKAHSL-KSSFIOAISA-N
Mol Weight 320.5 g/mol
Molecular Formula C19H32N2O2
Exact Mass 320.246378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IALKhA1onx1
Name N-(2-Acetyl-1-cyclohexenyl)-L-isoleucine piperidide
Alternate Name(s) 1-(2-{[(1S,2S)-2-methyl-1-(1-piperidinylcarbonyl)butyl]amino}-1-cyclohexen-1-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32N2O2
InChI InChI=1S/C19H32N2O2/c1-4-14(2)18(19(23)21-12-8-5-9-13-21)20-17-11-7-6-10-16(17)15(3)22/h14,18,20H,4-13H2,1-3H3/t14-,18-/m0/s1
InChIKey WTHKOOUTZKAHSL-KSSFIOAISA-N
Molecular Weight 320.477 g/mol
SMILES N(C1=C(C(=O)C)CCCC1)[C@](C(N1CCCCC1)=O)([C@](CC)(C)[H])[H]
SPLASH splash10-0a4i-2390000000-f59f005fbd38dc95f550
Source of Spectrum QE-7-1020-3
Wiley ID 845364