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Methylphenidate AC
SpectraBase Compound ID 9KTvGRNfUG4
InChI InChI=1S/C16H21NO3/c1-12(18)17-11-7-6-10-14(17)15(16(19)20-2)13-8-4-3-5-9-13/h3-5,8-9,14-15H,6-7,10-11H2,1-2H3
InChIKey RXBIAYQZRPJNGE-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ekH2l21U8g
Name Methyl (1-acetyl-2-piperidinyl)(phenyl)acetate
CAS Registry Number 27765-89-5
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 275.152143537 u
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-12(18)17-11-7-6-10-14(17)15(16(19)20-2)13-8-4-3-5-9-13/h3-5,8-9,14-15H,6-7,10-11H2,1-2H3
InChIKey RXBIAYQZRPJNGE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 275.348 g/mol
Nominal Mass 275 u
Quality 996
Retention Index 2081
SMILES C1(C(C2=CC=CC=C2)C(OC)=O)N(C(=O)C)CCCC1
SPLASH splash10-003r-9600000000-b08a3f266525b1c25b02
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms methyl (1-acetylpiperidin-2-yl)(phenyl)acetate
Technique GC/MS
Wiley ID DD2024_033216