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Cumene
SpectraBase Compound ID 2LwZ3kFDCId
InChI InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey RWGFKTVRMDUZSP-UHFFFAOYSA-N
Mol Weight 120.19 g/mol
Molecular Formula C9H12
Exact Mass 120.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1RUhz84vyK
Name cumene
Carrier Gas (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 120.093900386 u
Formula C9H12
GC Column DB-5 (30 m x 250 micrometer, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
InChI InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey RWGFKTVRMDUZSP-UHFFFAOYSA-N
Instrument Name Agilent 6890-5973 MSD
Ionization Type EI
Literature Reference DOI 10.1002/anie.202307042
Molecular Weight 120.195 g/mol
SMILES C1=CC(=CC=C1)C(C)C
SPLASH splash10-0a4i-3900000000-7650c51f7b9c0b25daae
Source of Spectrum ACI-62-SM11-Figure S4-2 (DOI: 10.1002/anie.202307042)
Wiley ID 1911918