SpectraBase Spectrum ID |
GmOPE4y04Y0 |
Name |
1,1-bis(Methoxycarbonyl)-2-[1'-(4''-methylphenyl)ethenyl]cyclopropane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
274.120509056 u |
Formula |
C16H18O4 |
InChI |
InChI=1S/C16H18O4/c1-10-5-7-12(8-6-10)11(2)13-9-16(13,14(17)19-3)15(18)20-4/h5-8,13H,2,9H2,1,3-4H3 |
InChIKey |
PWUXJPRZKYNESS-UHFFFAOYSA-N |
SMILES |
C1(C(C(C=2C=CC(=CC2)C)=C)C1)(C(=O)OC)C(=O)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863972 |