| SpectraBase Spectrum ID |
17FcqFRKXMJ |
| Name |
6-Benzofuranol, 7-bromo-2,3-dihydro-4-methoxy-3-methyl-5-(3-methyl-2-methylenebutyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.067407533 u |
| Formula |
C16H21BrO3 |
| InChI |
InChI=1S/C16H21BrO3/c1-8(2)9(3)6-11-14(18)13(17)16-12(15(11)19-5)10(4)7-20-16/h8,10,18H,3,6-7H2,1-2,4-5H3 |
| InChIKey |
MIVZLHGKJKDOTD-UHFFFAOYSA-N |
| Molecular Weight |
341.245 g/mol |
| SMILES |
C=1(C(=C2C(COC2=C(C1O)Br)C)OC)CC(=C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945662 |
