SpectraBase Spectrum ID |
IUftvYPd8S0 |
Name |
2-Acetoxy-7-formyl-4a,7-dimethyl-8-(3-chloroprop-2-yn-1-yl)decahydrophenanthrene |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H29ClO3 |
InChI |
InChI=1S/C22H29ClO3/c1-15(25)26-17-8-11-22(3)16(13-17)6-7-18-19(5-4-12-23)21(2,14-24)10-9-20(18)22/h6,14,17-20H,5,7-11,13H2,1-3H3/t17-,18-,19-,20-,21+,22-/m0/s1 |
InChIKey |
IGVARCAUFOFRCZ-LLTZGFESSA-N |
Molecular Weight |
376.924 g/mol |
SMILES |
[C@]12(C(=CC[C@@]3([C@@]2(CC[C@@](C=O)(C)[C@]3(CC#CCl)[H])[H])[H])C[C@@](OC(=O)C)(CC1)[H])C |
SPLASH |
splash10-014i-0009000000-b18a6a9d0549c68bc596 |
Source of Spectrum |
Y1-38-281-7 |
Synonyms |
(3beta)-16-(chloromethylene)-17-oxoandrost-5-en-3-yl acetate
3.beta.-Acetoxy-16(E)-chloroethyneneandrost-5-ene-17-al
3.beta.-Acetoxy-16(E)-chloromethyleneandrost-5-ene-17-one |
Wiley ID |
1527597 |