SpectraBase Spectrum ID |
9yoIXm9sOUB |
Name |
Oxirane, [1-(1-methoxyethoxy)-2-(phenylmethoxy)ethyl]-, [2R-[2R*[R*(S*)]]]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
252.136159120 u |
Formula |
C14H20O4 |
InChI |
InChI=1S/C14H20O4/c1-11(15-2)18-14(13-10-17-13)9-16-8-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3/t11?,13-,14+/m0/s1 |
InChIKey |
KTIVLCOPRXFJTN-SBKAZOPESA-N |
Molecular Weight |
252.310 g/mol |
SMILES |
[C@]1(OC1)([C@](OC(OC)C)(COCC=1C=CC=CC1)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890231 |