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(+)-MTPA 2-methyl-2,3-epoxyhept-6-en-1-yl ether
SpectraBase Compound ID Lr2W9hk3VvZ
InChI InChI=1S/C18H21F3O4/c1-4-5-11-14-16(2,25-14)12-24-15(22)17(23-3,18(19,20)21)13-9-7-6-8-10-13/h4,6-10,14H,1,5,11-12H2,2-3H3/t14-,16+,17?/m1/s1
InChIKey QCPRGFVSCFZFPR-UMFITKPXSA-N
Mol Weight 358.36 g/mol
Molecular Formula C18H21F3O4
Exact Mass 358.139194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9DK7xgqHpSB
Name (+)-MTPA 2-methyl-2,3-epoxyhept-6-en-1-yl ether
Alternate Name(s) [(2S,3R)-3-(3-butenyl)-2-methyloxiranyl]methyl 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21F3O4
InChI InChI=1S/C18H21F3O4/c1-4-5-11-14-16(2,25-14)12-24-15(22)17(23-3,18(19,20)21)13-9-7-6-8-10-13/h4,6-10,14H,1,5,11-12H2,2-3H3/t14-,16+,17?/m1/s1
InChIKey QCPRGFVSCFZFPR-UMFITKPXSA-N
Molecular Weight 358.357 g/mol
SMILES [C@@]1(O[C@@]1(CCC=C)[H])(COC(C(C(F)(F)F)(c1ccccc1)OC)=O)C
SPLASH splash10-052f-0917000000-fde94aa3905f3c82ce3c
Source of Spectrum F-48-402-25
Wiley ID 1346918