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3-Methyl-2-(1'-cyanocyclohexyl)-6-isopropoxy-1-oxa-2,5-diaza-4-oxocyclohexane
SpectraBase Compound ID LBgQm7f8NQF
InChI InChI=1S/C14H23N3O3/c1-10(2)19-13-16-12(18)11(3)17(20-13)14(9-15)7-5-4-6-8-14/h10-11,13H,4-8H2,1-3H3,(H,16,18)/t11-,13-/m1/s1
InChIKey AYUFJHPHKAFXGE-DGCLKSJQSA-N
Mol Weight 281.36 g/mol
Molecular Formula C14H23N3O3
Exact Mass 281.173942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID toUfETstu5
Name 3-Methyl-2-(1'-cyanocyclohexyl)-6-isopropoxy-1-oxa-2,5-diaza-4-oxocyclohexane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23N3O3
InChI InChI=1S/C14H23N3O3/c1-10(2)19-13-16-12(18)11(3)17(20-13)14(9-15)7-5-4-6-8-14/h10-11,13H,4-8H2,1-3H3,(H,16,18)/t11-,13-/m1/s1
InChIKey AYUFJHPHKAFXGE-DGCLKSJQSA-N
Molecular Weight 281.356 g/mol
SMILES N1C([C@](N(O[C@]1(OC(C)C)[H])C1(C#N)CCCCC1)(C)[H])=O
SPLASH splash10-0006-9000000000-949cc8f23ce93b5f04c6
Source of Spectrum F-52-7595-3c
Wiley ID 796799