| SpectraBase Spectrum ID |
EvME5WnKsyl |
| Name |
(R*,R*)-2-[(Ethylphenyl)hydroxymethyl]-6-hexanolide |
| Alternate Name(s) |
(3R)-3-[(R)-(2-ethylphenyl)(hydroxy)methyl]-2-oxepanone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3 |
| InChI |
InChI=1S/C15H20O3/c1-2-11-7-3-4-8-12(11)14(16)13-9-5-6-10-18-15(13)17/h3-4,7-8,13-14,16H,2,5-6,9-10H2,1H3/t13-,14+/m1/s1 |
| InChIKey |
AHAYNNRSCIJNOF-KGLIPLIRSA-N |
| Molecular Weight |
248.322 g/mol |
| SMILES |
O[C@]([C@@]1(C(OCCCC1)=O)[H])(c1c(CC)cccc1)[H] |
| SPLASH |
splash10-03di-0900000000-b4b89a4a2c01dcd0ad88 |
| Source of Spectrum |
E1-39-2865-6 |
| Wiley ID |
1519164 |
![(R*,R*)-2-[(Ethylphenyl)hydroxymethyl]-6-hexanolide](/api/spectrum/EvME5WnKsyl/structure.png?h=300&w=458 "(R*,R*)-2-[(Ethylphenyl)hydroxymethyl]-6-hexanolide")
