| SpectraBase Compound ID | 1b2KYumuD3c |
|---|---|
| InChI | InChI=1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3 |
| InChIKey | WHEUWNKSCXYKBU-UHFFFAOYSA-N |
| Mol Weight | 300.4 g/mol |
| Molecular Formula | C19H24O3 |
| Exact Mass | 300.172545 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3r5Xw6kBD76 |
|---|---|
| Name | Estra-1,3,5(10)-trien-17-one, 3-hydroxy-2-methoxy- |
| CAS Registry Number | 362-08-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C19H24O3 |
| InChI | InChI=1S/C19H24O3/c1-19-8-7-12-13(15(19)5-6-18(19)21)4-3-11-9-16(20)17(22-2)10-14(11)12/h9-10,12-13,15,20H,3-8H2,1-2H3 |
| InChIKey | WHEUWNKSCXYKBU-UHFFFAOYSA-N |
| Molecular Weight | 300.398 g/mol |
| SMILES | Oc1cc2CCC3C(CCC4(C)C3CCC4=O)c2cc1OC |
| SPLASH | splash10-0udi-2916000000-221c80788b532deb01a1 |
| Source of Spectrum | DE-0-5-0 |
| Synonyms | 3-Hydroxy-2-methoxyestra-1,3,5(10)-trien-17-one 2-Hydroxyestrone 2-methyl ether 2-Methoxy-13-methyl-3-oxidanyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one 2-Methoxy-17-oxoestra-1,3,5(10)-trien-3-ol 2-Methoxy-3-hydroxyestra-1,3,5(10)-trien-17-one 2-Methoxyestrone 3-Hydroxy-2-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one 3-Hydroxy-2-methoxyestra-1(10),2,4-trien-17-one Estrone, 2-methoxy- GSS 33 EINECS 206-645-6 |
| Wiley ID | 44565 |