| SpectraBase Spectrum ID |
4zVNBeSFIcI |
| Name |
4.BETA.,5.BETA.-EPOXY-ESTR-1-ENE-17.BETA.-OL-3-ONE(3-O-METHYLOXIME) |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
317.199093730 u |
| Formula |
C19H27NO3 |
| InChI |
InChI=1S/C19H27NO3/c1-18-9-7-12-11(13(18)4-6-16(18)21)8-10-19-14(12)3-5-15(20-22-2)17(19)23-19/h3,5,11-14,16-17,21H,4,6-10H2,1-2H3/b20-15+/t11-,12+,13+,14-,16+,17+,18+,19-/m1/s1 |
| InChIKey |
BMHVLTAEVTXQSD-SOUOQGSQSA-N |
| Molecular Weight |
317.429 g/mol |
| Nominal Mass |
317 u |
| Number of Peaks |
201 |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CC[C@@]45[C@](\C(C=C[C@@]5([C@]3(CC[C@]12C)[H])[H])=N\OC)(O4)[H])[H])[H])[H] |
| SPLASH |
splash10-014r-9785000000-6e466280389880fcdb3d |
| Source File Reference |
LMCM-51676-343B |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
7-HYDROXY-6A-METHYL-4A,4B,5,6,6A,7,8,9,9A,9B,10,11-DODECAHYDROCYCLOPENTA[7,8]PHENANTHRO[1,10A-B]OXIREN-2(1AH)-ONE O-METHYLOXIME |
| Wiley ID |
4_1416 |
