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

*Links on SpectraBase are not permalinks.

Cyclopropanecarboxylic acid, 1-chloro-2,2-dimethyl-3-phenyl-, 1,1-dimethylethyl ester, trans-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Cyclopropanecarboxylic acid, 1-chloro-2,2-dimethyl-3-phenyl-, 1,1-dimethylethyl ester, trans-
SpectraBase Compound ID 3lN2vcg7faV
InChI InChI=1S/C16H21ClO2/c1-14(2,3)19-13(18)16(17)12(15(16,4)5)11-9-7-6-8-10-11/h6-10,12H,1-5H3/t12-,16+/m0/s1
InChIKey FIGULGSZBMPXRL-BLLLJJGKSA-N
Mol Weight 280.8 g/mol
Molecular Formula C16H21ClO2
Exact Mass 280.123008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID Lu6AE1Qisfr
Name Cyclopropanecarboxylic acid, 1-chloro-2,2-dimethyl-3-phenyl-, 1,1-dimethylethyl ester, trans-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 280.123007614 u
Formula C16H21ClO2
InChI InChI=1S/C16H21ClO2/c1-14(2,3)19-13(18)16(17)12(15(16,4)5)11-9-7-6-8-10-11/h6-10,12H,1-5H3/t12-,16+/m0/s1
InChIKey FIGULGSZBMPXRL-BLLLJJGKSA-N
SMILES [C@]1(C(C)(C)[C@@]1(C=1C=CC=CC1)[H])(C(OC(C)(C)C)=O)Cl