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Benzyl 1-methyl-2-(trifluoromethyl)cyclopropane-1-carboxylate
SpectraBase Compound ID xTt0Gl048K
InChI InChI=1S/C13H13F3O2/c1-12(7-10(12)13(14,15)16)11(17)18-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKey NDYCRAJXONUGGF-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C13H13F3O2
Exact Mass 258.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PM1jcuGtmE
Name Benzyl 1-methyl-2-(trifluoromethyl)cyclopropane-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 258.086764146 u
Formula C13H13F3O2
InChI InChI=1S/C13H13F3O2/c1-12(7-10(12)13(14,15)16)11(17)18-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3
InChIKey NDYCRAJXONUGGF-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208936
Molecular Weight 258.240 g/mol
Quality 348
SMILES C1=CC(=CC=C1)COC(C1(CC1C(F)(F)F)C)=O
SPLASH splash10-0f6x-9610000000-7d0507b1f97cc60b4ed5
Source of Spectrum ACI-62-SM98-2 (DOI: 10.1002/anie.202208936)
Wiley ID 1908312