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

*Links on SpectraBase are not permalinks.
cis and trans-Diethyl 4-(7-chlorododecafluoroheptyl)-3-methylcyclopentane-1,1-dicarboxylate
SpectraBase Compound ID CtO99k209EE
InChI InChI=1S/C19H21ClF12O4/c1-4-35-11(33)13(12(34)36-5-2)6-9(3)10(7-13)8-14(21,22)15(23,24)16(25,26)17(27,28)18(29,30)19(20,31)32/h9-10H,4-8H2,1-3H3
InChIKey RRWCUYFSFCRNLD-UHFFFAOYSA-N
Mol Weight 576.81 g/mol
Molecular Formula C19H21ClF12O4
Exact Mass 576.093675 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 8vy0j7oKHuB
Name cis and trans-Diethyl 4-(7-chlorododecafluoroheptyl)-3-methylcyclopentane-1,1-dicarboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21ClF12O4
InChI InChI=1S/C19H21ClF12O4/c1-4-35-11(33)13(12(34)36-5-2)6-9(3)10(7-13)8-14(21,22)15(23,24)16(25,26)17(27,28)18(29,30)19(20,31)32/h9-10H,4-8H2,1-3H3
InChIKey RRWCUYFSFCRNLD-UHFFFAOYSA-N
Molecular Weight 576.807 g/mol
SMILES C(C(C(C(F)(F)Cl)(F)F)(F)F)(C(C(CC1CC(C(=O)OCC)(C(=O)OCC)CC1C)(F)F)(F)F)(F)F
SPLASH splash10-002f-0090080000-8f44b033b7b080f61503
Source of Spectrum KC-0-1731-4
Wiley ID 784053