For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ethyl 10-(heptafluorobutyryloxy)-11-methoxy-3,7,11-trimethyl-2,6-dodecadienoate
SpectraBase Compound ID BG1oW2rvgJR
InChI InChI=1S/C22H31F7O5/c1-7-33-17(30)13-15(3)10-8-9-14(2)11-12-16(19(4,5)32-6)34-18(31)20(23,24)21(25,26)22(27,28)29/h9,13,16H,7-8,10-12H2,1-6H3/b14-9+,15-13+
InChIKey HZNDHJIJLHRRTP-NNTZBSGJSA-N
Mol Weight 508.47 g/mol
Molecular Formula C22H31F7O5
Exact Mass 508.205971 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B0dHaAIQsq0
Name Ethyl 10-(heptafluorobutyryloxy)-11-methoxy-3,7,11-trimethyl-2,6-dodecadienoate
CAS Registry Number 69556-11-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31F7O5
InChI InChI=1S/C22H31F7O5/c1-7-33-17(30)13-15(3)10-8-9-14(2)11-12-16(19(4,5)32-6)34-18(31)20(23,24)21(25,26)22(27,28)29/h9,13,16H,7-8,10-12H2,1-6H3/b14-9+,15-13+
InChIKey HZNDHJIJLHRRTP-NNTZBSGJSA-N
Molecular Weight 508.474 g/mol
SMILES C(C(C(OC(C(OC)(C)C)CC\C(=C\CC\C(=C\C(=O)OCC)C)C)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-00e9-9400000000-24277be279a7bba9798f
Source of Spectrum W5-1989-10109-1
Synonyms Ethyl (2E,6E)-10-[(2,2,3,3,4,4,4-heptafluorobutanoyl)oxy]-11-methoxy-3,7,11-trimethyl-2,6-dodecadienoate
Wiley ID 1400106