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1-[(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl]-3-(2-methoxyethyl)urea
SpectraBase Compound ID 6BofGNWndPz
InChI InChI=1S/C14H28N2O2/c1-10(2)12-6-5-11(3)9-13(12)16-14(17)15-7-8-18-4/h10-13H,5-9H2,1-4H3,(H2,15,16,17)/t11-,12+,13+/m1/s1
InChIKey VTDWBHVKRICOQL-AGIUHOORSA-N
Mol Weight 256.39 g/mol
Molecular Formula C14H28N2O2
Exact Mass 256.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNin2r27NOA
Name 1-[(1S,2S,5R)-2-isopropyl-5-methyl-cyclohexyl]-3-(2-methoxyethyl)urea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28N2O2
InChI InChI=1S/C14H28N2O2/c1-10(2)12-6-5-11(3)9-13(12)16-14(17)15-7-8-18-4/h10-13H,5-9H2,1-4H3,(H2,15,16,17)/t11-,12+,13+/m1/s1
InChIKey VTDWBHVKRICOQL-AGIUHOORSA-N
Ionization Type EI
Molecular Weight 256.390 g/mol
SMILES N(CCOC)C(=O)N[C@@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H]
SPLASH splash10-00ec-9000000000-a594b98873fdcdaad78d
Source of Spectrum EP2135516B1
Wiley ID 1844976