SpectraBase Compound ID | 4MlxYg4kTst |
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InChI | InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,18-21,26H,4,6-13H2,1,3H3/t18-,19+,20+,21-,22-,23-/m0/s1 |
InChIKey | KIQQMECNKUGGKA-GOMYTPFNSA-N |
Mol Weight | 369.51 g/mol |
Molecular Formula | C23H31NO3 |
Exact Mass | 369.230394 g/mol |
SpectraBase Spectrum ID | 5st5kxziddc |
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Name | Norgestimate |
Source of Sample | Steraloids Inc. |
Catalog Number | E3530-000 |
Lot Number | C258 |
Accessory | DurasamplIR II |
CAS Registry Number | 35189-28-7 |
Classification | Estrone type |
Copyright | Copyright © 2014-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C23H31NO3 |
InChI | InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,18-21,26H,4,6-13H2,1,3H3/t18-,19+,20+,21-,22-,23-/m0/s1 |
InChIKey | KIQQMECNKUGGKA-GOMYTPFNSA-N |
Instrument Name | Bio-Rad FTS |
Melting Point | 120.0 - 130.0 °C |
Source of Spectrum | Forensic Spectral Research |
Synonyms | 4-Estren-17a- ethynyl-18-homo-17b- ol-3-one(-)-acetate-oxime |
Technique | ATR-Neat (DuraSamplIR II) |