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Estra-1,3,5(10)-trien-6-one, 3,17-bis(acetyloxy)-2-methoxy-, 6-(O-methyloxime), (17.beta.)-
SpectraBase Compound ID 2Fe5a1N9J9s
InChI InChI=1S/C24H31NO6/c1-13(26)30-22-12-18-16(11-21(22)28-4)15-8-9-24(3)19(6-7-23(24)31-14(2)27)17(15)10-20(18)25-29-5/h11-12,15,17,19,23H,6-10H2,1-5H3/b25-20+/t15-,17-,19+,23+,24+/m1/s1
InChIKey VZEYRSJACUGZDN-YLFWPYKXSA-N
Mol Weight 429.51 g/mol
Molecular Formula C24H31NO6
Exact Mass 429.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pzMXzR6jp2
Name Estra-1,3,5(10)-trien-6-one, 3,17-bis(acetyloxy)-2-methoxy-, 6-(O-methyloxime), (17.beta.)-
Alternate Name(s) (17beta)-17-(acetyloxy)-2-methoxy-6-(methoxyimino)estra-1,3,5(10)-trien-3-yl acetate
CAS Registry Number 77883-00-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO6
InChI InChI=1S/C24H31NO6/c1-13(26)30-22-12-18-16(11-21(22)28-4)15-8-9-24(3)19(6-7-23(24)31-14(2)27)17(15)10-20(18)25-29-5/h11-12,15,17,19,23H,6-10H2,1-5H3/b25-20+/t15-,17-,19+,23+,24+/m1/s1
InChIKey VZEYRSJACUGZDN-YLFWPYKXSA-N
Molecular Weight 429.513 g/mol
SMILES c12c(\C(=N\OC)C[C@@]3([C@@]2(CC[C@@]2([C@@](OC(=O)C)(CC[C@@]32[H])[H])C)[H])[H])cc(c(c1)OC)OC(=O)C
SPLASH splash10-000i-1009000000-8dd047a8eb1cf129e15d
Source of Spectrum W5-0-0-0
Wiley ID 1381192