| SpectraBase Spectrum ID |
39e7twoNZIE |
| Name |
(1S,3S)-3-Ethyl-2,2-diphenyl-cyclopropanecarbaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.135765199 u |
| Formula |
C18H18O |
| InChI |
InChI=1S/C18H18O/c1-2-16-17(13-19)18(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13,16-17H,2H2,1H3/t16-,17-/m0/s1 |
| InChIKey |
GVLDAPLFGZEZIL-IRXDYDNUSA-N |
| Molecular Weight |
250.341 g/mol |
| SMILES |
C1([C@](C=O)([H])[C@@]1(CC)[H])(C=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.917243 |
