| SpectraBase Spectrum ID |
1CgVMOXKwi |
| Name |
17,20-Epoxy-17.xi.-pregna-4,20-dien-3-one |
| Alternate Name(s) |
(2'R,15'S)-2',15'-dimethyl-3-methylidenespiro[oxirane-2,14'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan]-6'-en-5'-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H28O2 |
| InChI |
InChI=1S/C21H28O2/c1-13-21(23-13)11-8-18-16-5-4-14-12-15(22)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18H,1,4-11H2,2-3H3/t16?,17?,18?,19-,20-,21+/m0/s1 |
| InChIKey |
CVOJTXOPINFODS-WZSRHMHXSA-N |
| Molecular Weight |
312.453 g/mol |
| SMILES |
[C@]12(OC2=C)[C@@]2(C(C3CCC=4[C@@](C3CC2)(CCC(=O)C4)C)CC1)C |
| SPLASH |
splash10-03k9-0069000000-19dd6e454c7207ecbc99 |
| Source of Spectrum |
AH-124-1172-3 |
| Wiley ID |
1313908 |
