SpectraBase Spectrum ID |
LNzoDrfU9hp |
Name |
Benzofuran, 2,3-dihydro-2-methyl-2-(1-methyl-1-propenyl)-, (Z)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
188.120115134 u |
Formula |
C13H16O |
InChI |
InChI=1S/C13H16O/c1-4-10(2)13(3)9-11-7-5-6-8-12(11)14-13/h4-8H,9H2,1-3H3/b10-4- |
InChIKey |
QUSFWAOHIIVBJF-WMZJFQQLSA-N |
Molecular Weight |
188.270 g/mol |
SMILES |
C1(OC2=CC=CC=C2C1)(\C(=C/C)C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938647 |