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3-Isopropenyl dimethyl benzyl isocyanate

View entire compound with spectra: 3 NMR, and 5 FTIR

3-Isopropenyl dimethyl benzyl isocyanate
SpectraBase Compound ID 89n8u11CL26
InChI InChI=1S/C13H15NO/c1-10(2)11-6-5-7-12(8-11)13(3,4)14-9-15/h5-8H,1H2,2-4H3
InChIKey ZVEMLYIXBCTVOF-UHFFFAOYSA-N
Mol Weight 201.27 g/mol
Molecular Formula C13H15NO
Exact Mass 201.115364 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3N5qgJzgAog
Name 3-Isopropenyl-alpha,alpha-dimethylbenzyl isocyanate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 361771
CAS Registry Number 2094-99-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO
InChI InChI=1S/C13H15NO/c1-10(2)11-6-5-7-12(8-11)13(3,4)14-9-15/h5-8H,1H2,2-4H3
InChIKey ZVEMLYIXBCTVOF-UHFFFAOYSA-N
Observed nucleus 1H
Purity 95%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_007471