| SpectraBase Spectrum ID |
G24vl8AHhCz |
| Name |
(1RS,3RS,5SR,7SR,8RS)-8-Chloro-3-(2-chloroethyl)-1-methyl-6-oxo-2-oxaadamantane-5-carboxylic acid methyl ester |
| Alternate Name(s) |
(1RS,3RS,5SR,7SR,8RS)-8-Chloro-3-(2-chloroethoxy)-1-methyl-6-oxo-2-oxaadamantane-5-carboxylic acid methyl ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18Cl2O5 |
| InChI |
InChI=1S/C14H18Cl2O5/c1-12-6-13(11(18)19-2)7-14(21-12,20-4-3-15)5-8(9(12)16)10(13)17/h8-9H,3-7H2,1-2H3/t8-,9-,12-,13+,14-/m1/s1 |
| InChIKey |
DGAKNGVBECQVBT-UYYBAZKBSA-N |
| Molecular Weight |
337.199 g/mol |
| SMILES |
[C@]12(C([C@@]3(C[C@](C2)(O[C@](C1)([C@@]3(Cl)[H])C)OCCCl)[H])=O)C(=O)OC |
| SPLASH |
splash10-03di-0902000000-9dc3ffcfe2c9f8f54c8b |
| Source of Spectrum |
H1-39-109-13 |
| Wiley ID |
756836 |
