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1-(1-Phenylpropan-2-yl)piperidin-4-yl 4-methyl benzoate
SpectraBase Compound ID Bh9lXdicvd5
InChI InChI=1S/C22H27NO2/c1-17-8-10-20(11-9-17)22(24)25-21-12-14-23(15-13-21)18(2)16-19-6-4-3-5-7-19/h3-11,18,21H,12-16H2,1-2H3
InChIKey UXOSFGPXHKFOJU-UHFFFAOYSA-N
Mol Weight 337.46 g/mol
Molecular Formula C22H27NO2
Exact Mass 337.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hyy8aUoWXTR
Name 1-(1-Phenylpropan-2-yl)piperidin-4-yl 4-methyl benzoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 337.204179111 u
Formula C22H27NO2
InChI InChI=1S/C22H27NO2/c1-17-8-10-20(11-9-17)22(24)25-21-12-14-23(15-13-21)18(2)16-19-6-4-3-5-7-19/h3-11,18,21H,12-16H2,1-2H3
InChIKey UXOSFGPXHKFOJU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 337.463 g/mol
Nominal Mass 337 u
Quality 782
Retention Index 2593
SMILES C1(OC(C2=CC=C(C=C2)C)=O)CCN(C(CC2=CC=CC=C2)C)CC1
SPLASH splash10-0002-5290000000-50eabbfc63ac9639dda8
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(1-Phenylpropan-2-yl)piperidin-4-yl-4-methyl benzoate
Technique GC/MS
Wiley ID DD2024_027022