For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
16.alpha.-Hydroxy-7.alpha.-methyl-4-estren-3,17-dione
SpectraBase Compound ID IA76U277UQQ
InChI InChI=1S/C19H26O3/c1-10-7-11-8-12(20)3-4-13(11)14-5-6-19(2)15(17(10)14)9-16(21)18(19)22/h8,10,13-17,21H,3-7,9H2,1-2H3/t10-,13+,14-,15+,16-,17-,19+/m1/s1
InChIKey ZVXNPBQBIGBNPN-CKDDSQOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4gjXeQt3kVg
Name 16.alpha.-Hydroxy-7.alpha.-methyl-4-estren-3,17-dione
Alternate Name(s) (7alpha,16alpha)-16-hydroxy-7-methylestr-4-ene-3,17-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-10-7-11-8-12(20)3-4-13(11)14-5-6-19(2)15(17(10)14)9-16(21)18(19)22/h8,10,13-17,21H,3-7,9H2,1-2H3/t10-,13+,14-,15+,16-,17-,19+/m1/s1
InChIKey ZVXNPBQBIGBNPN-CKDDSQOYSA-N
Molecular Weight 302.414 g/mol
SMILES O[C@@]1(C[C@]2([C@@]3([C@@](CC4=CC(CC[C@@]4([C@]3(CC[C@@]2(C1=O)C)[H])[H])=O)(C)[H])[H])[H])[H]
SPLASH splash10-0kh9-8974000000-055fadb1831051f3cbe1
Source of Spectrum E1-35-2126-36
Wiley ID 1574348