| SpectraBase Spectrum ID |
FlXrtHQamGP |
| Name |
6-Allyl-2,3-dihydro-1,4-benzodioxine-5-carboxylic acid |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.073558862 u |
| Formula |
C12H12O4 |
| InChI |
InChI=1S/C12H12O4/c1-2-3-8-4-5-9-11(10(8)12(13)14)16-7-6-15-9/h2,4-5H,1,3,6-7H2,(H,13,14) |
| InChIKey |
OQQUHDPDDUXAFV-UHFFFAOYSA-N |
| Instrument Name |
Waters GCT Premier CAB163 |
| Ionization Type |
EI Positive ion |
| Literature Reference DOI |
10.1002/anie.201712520 |
| Molecular Weight |
220.224 g/mol |
| Quality |
284 |
| Reported Formula |
C12H12O4 |
| SMILES |
OC(C1=C(CC=C)C=CC2=C1OCCO2)=O |
| SPLASH |
splash10-0q2a-0790000000-98d76aa1690bfbb23e8a |
| Source of Spectrum |
ACI-57-SM12-3na (DOI: 10.1002/anie.201712520) |
| Wiley ID |
1893530 |
