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m-Toluoyl chloride
SpectraBase Compound ID 8c9O6C425MN
InChI InChI=1S/C8H7ClO/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
InChIKey YHOYYHYBFSYOSQ-UHFFFAOYSA-N
Mol Weight 154.6 g/mol
Molecular Formula C8H7ClO
Exact Mass 154.018543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVCVjwySzi4
Name 3-Methylbenzoylchloride
CAS Registry Number 1711-06-4
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 154.018542544 u
Formula C8H7ClO
InChI InChI=1S/C8H7ClO/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
InChIKey YHOYYHYBFSYOSQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 154.596 g/mol
Nominal Mass 154 u
Quality 920
Retention Index 1150
SMILES C=1(C(Cl)=O)C=C(C=CC1)C
SPLASH splash10-014l-9600000000-89a6511aac8130cf5599
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Benzoyl chloride,3-methyl 3-Methylbenzoyl chloride
Technique GC/MS
Wiley ID DD2024_026563