SpectraBase Spectrum ID |
5DuTIIz6j7 |
Name |
Estrone 3-methyl ether |
Source of Sample |
Sigma-Aldrich Company LLC |
Catalog Number |
E9875 |
Lot Number |
28F-7706 |
CAS Registry Number |
1624-62-0 |
Cell Type |
NMR tube |
Compound Type |
Pure |
Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H24O2 |
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 |
InChIKey |
BCWWDWHFBMPLFQ-VXNCWWDNSA-N |
Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
Raman Laser Power |
1401 mW |
Raman Laser Source |
Nd:YAG |
SMILES |
c1(OC)cc2CC[C@]3([C@]4([C@](CC[C@@]3(c2cc1)[H])(C(CC4)=O)C)[H])[H] |
Scans Performed |
2496 |
Source of Spectrum |
Forensic Spectral Research |
Technique |
FT-Raman |