| SpectraBase Spectrum ID |
510X3mN6n0c |
| Name |
(2E)-2-(phenylmethylene)butane-1,4-diol |
| Alternate Name(s) |
(2E)-2-(phenylmethylidene)butane-1,4-diol
(2E)-2-benzalbutane-1,4-diol
(2E)-2-benzylidenebutane-1,4-diol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c12-7-6-11(9-13)8-10-4-2-1-3-5-10/h1-5,8,12-13H,6-7,9H2/b11-8+ |
| InChIKey |
PPYYXQAOODXXRG-DHZHZOJOSA-N |
| Molecular Weight |
178.231 g/mol |
| SMILES |
OCC\C(CO)=C\c1ccccc1 |
| SPLASH |
splash10-0006-9200000000-307ff6f2ef7fa7940e50 |
| Source of Spectrum |
SO-0-957-2 |
| Wiley ID |
1541702 |
