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Methyl 2-isopropyl-3-methyl-5-phenyl-1-pyrroline-4-carboxylate (3,4-trans-4,5-cis)

View entire compound with spectra: 1 MS (GC)

Methyl 2-isopropyl-3-methyl-5-phenyl-1-pyrroline-4-carboxylate (3,4-trans-4,5-cis)
SpectraBase Compound ID DVsaXnHsUzm
InChI InChI=1S/C16H21NO2/c1-10(2)14-11(3)13(16(18)19-4)15(17-14)12-8-6-5-7-9-12/h5-11,13,15H,1-4H3
InChIKey LPEWXAVTRVVJSD-UHFFFAOYSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GSwkpPW72Vj
Name Methyl 2-isopropyl-3-methyl-5-phenyl-1-pyrroline-4-carboxylate (3,4-trans-4,5-cis)
Alternate Name(s) Methyl (4r,5s)-2-isopropyl-3-methyl-5-phenyl-1-pyrroline-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-10(2)14-11(3)13(16(18)19-4)15(17-14)12-8-6-5-7-9-12/h5-11,13,15H,1-4H3
InChIKey LPEWXAVTRVVJSD-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 259.349 g/mol
SMILES COC(=O)C1C(C)C(=NC1c1ccccc1)C(C)C
SPLASH splash10-0a4i-1930000000-72a7530af389d516c9ae
Source of Spectrum SRH-2022-10288-0
Wiley ID 1831907