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

*Links on SpectraBase are not permalinks.

Methanesulfonic acid, trifluoro-, 4-[2,6-bis(1-ethoxyethoxy)-4-pentylphenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl ester

View entire compound with spectra: 1 MS (GC)

Methanesulfonic acid, trifluoro-, 4-[2,6-bis(1-ethoxyethoxy)-4-pentylphenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl ester
SpectraBase Compound ID 5hJkxmbIYoU
InChI InChI=1S/C29H43F3O7S/c1-8-11-12-13-20-14-25(37-18(4)35-9-2)27(26(15-20)38-19(5)36-10-3)21-16-24(23-17-22(21)28(23,6)7)39-40(33,34)29(30,31)32/h14-16,18-19,21-23H,8-13,17H2,1-7H3
InChIKey JUSKKBRTXPQUJL-UHFFFAOYSA-N
Mol Weight 592.7 g/mol
Molecular Formula C29H43F3O7S
Exact Mass 592.268159 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 BmnBTDy3R2K
Name Methanesulfonic acid, trifluoro-, 4-[2,6-bis(1-ethoxyethoxy)-4-pentylphenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl ester
CAS Registry Number 128660-92-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H43F3O7S
InChI InChI=1S/C29H43F3O7S/c1-8-11-12-13-20-14-25(37-18(4)35-9-2)27(26(15-20)38-19(5)36-10-3)21-16-24(23-17-22(21)28(23,6)7)39-40(33,34)29(30,31)32/h14-16,18-19,21-23H,8-13,17H2,1-7H3
InChIKey JUSKKBRTXPQUJL-UHFFFAOYSA-N
Molecular Weight 592.711 g/mol
SMILES C(S(OC1=CC(c2c(OC(OCC)C)cc(cc2OC(OCC)C)CCCCC)C2CC1C2(C)C)(=O)=O)(F)(F)F
SPLASH splash10-05gj-8542900000-8683aa924cf96cb3117c
Source of Spectrum J-55-5713-6
Synonyms 4-[2,6-bis(1-ethoxyethoxy)-4-pentylphenyl]-6,6-dimethylbicyclo[3.1.1]hept-2-en-2-yl trifluoromethanesulfonate
Wiley ID 1409467