SpectraBase Spectrum ID |
7Z7fQAWnFE4 |
Name |
Tiglic acid |
CAS Registry Number |
80-59-1 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C5H8O2 |
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/C5H8O2/c1-3-4(2)5(6)7/h3H,1-2H3,(H,6,7)/b4-3+ |
InChIKey |
UIERETOOQGIECD-ONEGZZNKSA-N |
Molecular Weight |
100.117 g/mol |
SMILES |
OC(\C(=C\C)C)=O |
SPLASH |
splash10-0zfr-9200000000-606bf76d4ac872988e92 |
Source |
ex BEDOUKIAN RES. |
Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
Wiley ID |
1887862 |