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

*Links on SpectraBase are not permalinks.
17.beta.-Acetoxy-estra-2,5(10)-diene-1,4-dione
SpectraBase Compound ID LRMXs1QG41R
InChI InChI=1S/C20H24O4/c1-11(21)24-18-8-5-15-12-3-4-14-16(22)6-7-17(23)19(14)13(12)9-10-20(15,18)2/h6-7,12-13,15,18H,3-5,8-10H2,1-2H3/t12-,13+,15+,18+,20+/m1/s1
InChIKey UWNFXCPBVBRXBN-NIOLETKNSA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 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 2N8EEF3y1w
Name 17.beta.-Acetoxy-estra-2,5(10)-diene-1,4-dione
Alternate Name(s) (17beta)-1,4-dioxoestra-2,5(10)-dien-17-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-11(21)24-18-8-5-15-12-3-4-14-16(22)6-7-17(23)19(14)13(12)9-10-20(15,18)2/h6-7,12-13,15,18H,3-5,8-10H2,1-2H3/t12-,13+,15+,18+,20+/m1/s1
InChIKey UWNFXCPBVBRXBN-NIOLETKNSA-N
Molecular Weight 328.408 g/mol
SMILES C1=2[C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(OC(=O)C)[H])[H])([H])CCC2C(=O)C=CC1=O)[H]
SPLASH splash10-014r-0090000000-9a7d9b811f2f2fa6d4ed
Source of Spectrum Y5-62-764-4
Wiley ID 879372