| SpectraBase Spectrum ID |
JSRbAk65aAO |
| Name |
Methyl-3(2-furyl)acrolein<2E-> |
| CAS Registry Number |
108576-21-2 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
136.052429496 u |
| Formula |
C8H8O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness) |
| GC Oven Program |
60 °C to 246 °C at 3 °C/min. |
| InChI |
InChI=1S/C8H8O2/c1-7(6-9)5-8-3-2-4-10-8/h2-6H,1H3/b7-5+ |
| InChIKey |
ZNBXZUKDRRRQJK-FNORWQNLSA-N |
| Molecular Weight |
136.150 g/mol |
| Nominal Mass |
136 u |
| Number of Peaks |
62 |
| SMILES |
c1cc(oc1)\C=C\(C=O)C |
| SPLASH |
splash10-0kdr-9400000000-99ce87414132f5afb60d |
| Source |
ex BEDOUKIAN CHEM ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
RA000965 |
