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Ethynodiol diacetate
SpectraBase Compound ID Dmk2x9ppFhu
InChI InChI=1S/C24H32O4/c1-5-24(28-16(3)26)13-11-22-21-8-6-17-14-18(27-15(2)25)7-9-19(17)20(21)10-12-23(22,24)4/h1,14,18-22H,6-13H2,2-4H3/t18-,19-,20+,21+,22-,23-,24-/m0/s1
InChIKey ONKUMRGIYFNPJW-KIEAKMPYSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID DGlDjo732p2
Name Ethynodiol diacetate
Source of Sample Sigma-Aldrich Company LLC
Catalog Number E7263
Lot Number 040H0345
CAS Registry Number 297-76-7
Cell Type Neat on gold post
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-5-24(28-16(3)26)13-11-22-21-8-6-17-14-18(27-15(2)25)7-9-19(17)20(21)10-12-23(22,24)4/h1,14,18-22H,6-13H2,2-4H3/t18-,19-,20+,21+,22-,23-,24-/m0/s1
InChIKey ONKUMRGIYFNPJW-KIEAKMPYSA-N
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES C1C[C@@](C=C2CC[C@]3([C@]4([C@](CC[C@@]3([C@@]12[H])[H])([C@](CC4)(OC(=O)C)C#C)C)[H])[H])(OC(C)=O)[H]
Scans Performed 1792
Source of Spectrum Forensic Spectral Research
Synonyms (3β, 17α)-19-Norpregn-4-en-20-yne-3,17-diol diacetate; 3β,17β-Diacetoxy-17α-ethynyl-4-estrene
Technique FT-Raman