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

*Links on SpectraBase are not permalinks.

Tert-butyl 3-cyano-2-((tert-butyloxy)-carbonyl)but-2-enoate

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

Tert-butyl 3-cyano-2-((tert-butyloxy)-carbonyl)but-2-enoate
SpectraBase Compound ID E1ySQaBSSyR
InChI InChI=1S/C14H21NO4/c1-9(8-15)10(11(16)18-13(2,3)4)12(17)19-14(5,6)7/h1-7H3
InChIKey LNEBIDMBASUSEB-UHFFFAOYSA-N
Mol Weight 267.32 g/mol
Molecular Formula C14H21NO4
Exact Mass 267.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID CGM2fRrJJWX
Name Tert-butyl 3-cyano-2-((tert-butyloxy)-carbonyl)but-2-enoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 267.147058156 u
Formula C14H21NO4
InChI InChI=1S/C14H21NO4/c1-9(8-15)10(11(16)18-13(2,3)4)12(17)19-14(5,6)7/h1-7H3
InChIKey LNEBIDMBASUSEB-UHFFFAOYSA-N
Molecular Weight 267.325 g/mol
SMILES C(C(OC(C)(C)C)=O)(C(OC(C)(C)C)=O)=C(C#N)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813128