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methyl 4-(3-methylbut-2-en-1-yl)benzoate
SpectraBase Compound ID 50MAIP5JhqL
InChI InChI=1S/C13H16O2/c1-10(2)4-5-11-6-8-12(9-7-11)13(14)15-3/h4,6-9H,5H2,1-3H3
InChIKey SDWKGHNYZDPJHM-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HFEAXxtDDEK
Name methyl 4-(3-methylbut-2-en-1-yl)benzoate
Appearance Oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-10(2)4-5-11-6-8-12(9-7-11)13(14)15-3/h4,6-9H,5H2,1-3H3
InChIKey SDWKGHNYZDPJHM-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201900356
Molecular Weight 204.269 g/mol
SMILES c1(ccc(cc1)CC=C(C)C)C(=O)OC
SPLASH splash10-002b-3900000000-86bee081cfbb27c08a4e
Source of Spectrum U1-2020-SM53-3a
Wiley ID 1858753