| SpectraBase Spectrum ID |
IPTxQ3IBPKz |
| Name |
Ether-type-condensation product of an aromatic hydrocarbon (xylene) and formaldehyde; structure is idealized |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
208.182715392 u |
| Formula |
C14H24O |
| InChI |
InChI=1S/C10H14.C4H10O/c1-7-5-8(2)10(4)9(3)6-7;1-3-5-4-2/h5-6H,1-4H3;3-4H2,1-2H3 |
| InChIKey |
IEHWWTXOCQUMDY-UHFFFAOYSA-N |
| Molecular Weight |
208.345 g/mol |
| SMILES |
C1(=C(C(=CC(=C1)C)C)C)C.CCOCC |
| Spectrum/Structure Validation Score (Raman) |
0.9731 |
