| SpectraBase Spectrum ID |
HGh9A8SBNKd |
| Name |
Hemiacetal Cage Compound 4,11-Dioxa-9-hydroxy-3,5-dimethyltetracycloundecane-3-ol 3-chlorobenzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H19ClO5 |
| InChI |
InChI=1S/C18H19ClO5/c1-17-13-11-7-10(14(20)15(11)22-17)12(13)18(2,24-17)23-16(21)8-4-3-5-9(19)6-8/h3-6,10-15,20H,7H2,1-2H3/t10-,11+,12-,13?,14-,15-,17?,18+/m1/s1 |
| InChIKey |
HODXZQVBGSOIST-WTVQSUEOSA-N |
| Molecular Weight |
350.798 g/mol |
| SMILES |
O[C@]1([C@@]2(OC3(C4[C@@]([C@]1(C[C@]24[H])[H])([C@](O3)(OC(c1cc(Cl)ccc1)=O)C)[H])C)[H])[H] |
| SPLASH |
splash10-0002-0901000000-357bf4e7365013f4d5da |
| Source of Spectrum |
J-62-6372-26 |
| Synonyms |
10-hydroxy-3,5-dimethyl-4,8-dioxatetracyclo[5.4.0.0(2,6).0(3,10)]undec-5-yl 3-chlorobenzoate |
| Wiley ID |
1341850 |
