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3-Phenylacetyl-5-pentyl-2-isoxazoline

View entire compound with spectra: 2 MS (GC)

3-Phenylacetyl-5-pentyl-2-isoxazoline
SpectraBase Compound ID LlzNTF9HG2O
InChI InChI=1S/C16H21NO2/c1-2-3-5-10-14-12-15(17-19-14)16(18)11-13-8-6-4-7-9-13/h4,6-9,14H,2-3,5,10-12H2,1H3
InChIKey YFVLMZMPHAZJIT-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 6G8gtqSKwnz
Name Ethanone, 1-(4,5-dihydro-5-pentyl-3-isoxazolyl)-2-phenyl-
Alternate Name(s) 1-(5-pentyl-4,5-dihydro-3-isoxazolyl)-2-phenylethanone 5-Pentyl-3-phenylacetyl-2-isoxazoline
CAS Registry Number 107487-19-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-2-3-5-10-14-12-15(17-19-14)16(18)11-13-8-6-4-7-9-13/h4,6-9,14H,2-3,5,10-12H2,1H3
InChIKey YFVLMZMPHAZJIT-UHFFFAOYSA-N
Molecular Weight 259.349 g/mol
SMILES C1(=NOC(C1)CCCCC)C(Cc1ccccc1)=O
SPLASH splash10-0a4l-4190000000-bc7753deabd87039ef3a
Source of Spectrum AJ-60-2471-11
Wiley ID 1262876