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2-Morpholino-5-(trifluoromethyl)benzyl pentanoate
SpectraBase Compound ID 7LhwkPXsGUK
InChI InChI=1S/C17H22F3NO3/c1-2-3-4-16(22)24-12-13-11-14(17(18,19)20)5-6-15(13)21-7-9-23-10-8-21/h5-6,11H,2-4,7-10,12H2,1H3
InChIKey ORMOWFXCJRFAKA-UHFFFAOYSA-N
Mol Weight 345.36 g/mol
Molecular Formula C17H22F3NO3
Exact Mass 345.155178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYfltGDUFzW
Name 2-Morpholino-5-(trifluoromethyl)benzyl pentanoate
Appearance Colorless oil
Carrier Gas Argon
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.155178058 u
Formula C17H22F3NO3
GC Column HP-5 (30 m x 0.32 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C17H22F3NO3/c1-2-3-4-16(22)24-12-13-11-14(17(18,19)20)5-6-15(13)21-7-9-23-10-8-21/h5-6,11H,2-4,7-10,12H2,1H3
InChIKey ORMOWFXCJRFAKA-UHFFFAOYSA-N
Instrument Name Agilent HP-7890A-AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202211939
Molecular Weight 345.362 g/mol
Quality 214
SMILES C1OCCN(C1)C1=C(C=C(C=C1)C(F)(F)F)COC(CCCC)=O
SPLASH splash10-03di-1392000000-2c6e1d2e92eef3fc7ad4
Source of Spectrum ACI-61-SM46-59 (DOI: 10.1002/anie.202211939)
Wiley ID 1899573