SpectraBase Spectrum ID |
Cw5jdP9Ykjv |
Name |
Trans-(+-)2,3-epoxy-5-phenyl-1-cyclopropylpent-4-en-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
214.099379689 u |
Formula |
C14H14O2 |
InChI |
InChI=1S/C14H14O2/c15-13(11-7-8-11)14-12(16-14)9-6-10-4-2-1-3-5-10/h1-6,9,11-12,14H,7-8H2/b9-6+ |
InChIKey |
OHVQCNSDHHTVFI-RMKNXTFCSA-N |
Molecular Weight |
214.264 g/mol |
Nominal Mass |
214 u |
SMILES |
C1(OC1\C=C\C1=CC=CC=C1)C(=O)C1CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.871618 |