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

*Links on SpectraBase are not permalinks.
16,16-D2-estrone methyl ether
SpectraBase Compound ID AOw4RwRHe6N
InChI InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1/i8D2
InChIKey BCWWDWHFBMPLFQ-POIPYZQVSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H222D2O2
Exact Mass 286.190184 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 9gY1GL1tu9v
Name 16,16-D2-estrone methyl ether
CAS Registry Number 41853-55-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22D2O2
InChI InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1/i8D2
InChIKey BCWWDWHFBMPLFQ-POIPYZQVSA-N
Molecular Weight 286.411 g/mol
SMILES [C@@]12([C@]([C@@]3(CCc4c([C@]3(CC2)[H])ccc(OC)c4)[H])(CC(C1=O)([2D])[2D])[H])C
SPLASH splash10-000i-2890000000-c383306f4cbff964fb64
Source of Spectrum O-7-370-1
Wiley ID 1288441