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17-(Methoxyimino)-2-nitroestra-1(10),2,4-trien-3-yl acetate
SpectraBase Compound ID 5SNzVViZtOA
InChI InChI=1S/C21H26N2O5/c1-12(24)28-19-10-13-4-5-15-14(16(13)11-18(19)23(25)26)8-9-21(2)17(15)6-7-20(21)22-27-3/h10-11,14-15,17H,4-9H2,1-3H3/b22-20+
InChIKey PRURCQDRZUVZPK-LSDHQDQOSA-N
Mol Weight 386.45 g/mol
Molecular Formula C21H26N2O5
Exact Mass 386.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KL15fP0ZkV
Name 17-(Methoxyimino)-2-nitroestra-1(10),2,4-trien-3-yl acetate
CAS Registry Number 77883-08-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O5
InChI InChI=1S/C21H26N2O5/c1-12(24)28-19-10-13-4-5-15-14(16(13)11-18(19)23(25)26)8-9-21(2)17(15)6-7-20(21)22-27-3/h10-11,14-15,17H,4-9H2,1-3H3/b22-20+
InChIKey PRURCQDRZUVZPK-LSDHQDQOSA-N
Molecular Weight 386.448 g/mol
SMILES CO\N=C/1CCC2C3CCc4cc(OC(C)=O)c(cc4C3CCC12C)N(=O)=O
SPLASH splash10-03di-2259000000-ea1e14ad62af1e2c3a16
Source of Spectrum W5-0-0-0
Synonyms Estra-1,3,5(10)-trien-17-one, 3-(acetyloxy)-2-nitro-, 17-(O-methyloxime)
Wiley ID 1362629