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3-Methoxyphenylacetone
SpectraBase Compound ID 7qmjT3cSq2b
InChI InChI=1S/C10H12O2/c1-8(11)6-9-4-3-5-10(7-9)12-2/h3-5,7H,6H2,1-2H3
InChIKey RMMRRRLPDBJBQL-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVFQpJLlaHQ
Name 3'-Methoxyphenyl-2-propanone
CAS Registry Number 3027-13-2
Classification Designer drug precursor
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 164.083729624 u
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-8(11)6-9-4-3-5-10(7-9)12-2/h3-5,7H,6H2,1-2H3
InChIKey RMMRRRLPDBJBQL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 164.204 g/mol
Nominal Mass 164 u
Quality 909
Retention Index 1191
SMILES C=1(C=C(C=CC1)OC)CC(=O)C
SPLASH splash10-006x-9600000000-896b9c3152f868e3b059
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-methoxyphenyl-2-propanone 1-(3-methoxyphenyl)propan-2-one
Technique GC/MS
Wiley ID DD2024_002053