| SpectraBase Spectrum ID |
BLhis9DcBib |
| Name |
ortho-Guaiacol |
| Alternate Name(s) |
Guaiacol |
| CAS Registry Number |
90-05-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H8O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3 |
| InChIKey |
LHGVFZTZFXWLCP-UHFFFAOYSA-N |
| Molecular Weight |
124.139 g/mol |
| SMILES |
Oc1c(OC)cccc1 |
| SPLASH |
splash10-0pir-9600000000-6bcbb7cc5f1a8ab15ec7 |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Wiley ID |
1886384 |
