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Benzene, (1-methyl-2-butynyl)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

Benzene, (1-methyl-2-butynyl)-
SpectraBase Compound ID Yur11BpHtC
InChI InChI=1S/C11H12/c1-3-7-10(2)11-8-5-4-6-9-11/h4-6,8-10H,1-2H3
InChIKey IQXKRMIPUKYQNF-UHFFFAOYSA-N
Mol Weight 144.22 g/mol
Molecular Formula C11H12
Exact Mass 144.0939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JR8AiWek39h
Name (1-Methyl-2-butynyl)benzene
CAS Registry Number 87712-69-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12
InChI InChI=1S/C11H12/c1-3-7-10(2)11-8-5-4-6-9-11/h4-6,8-10H,1-2H3
InChIKey IQXKRMIPUKYQNF-UHFFFAOYSA-N
Molecular Weight 144.217 g/mol
SMILES c1cc(ccc1)C(C)C#CC
SPLASH splash10-004i-5900000000-21dde858992077dc5da3
Synonyms 1-Methylbut-2-ynylbenzene Benzene, (1-methyl-2-butynyl)- Pent-3-yn-2-ylbenzene
Wiley ID 1492493