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3-ACETYLOXY-6-METHOXYPRIMNATRIENONE
SpectraBase Compound ID DIysOcNBU3e
InChI InChI=1S/C18H24O4/c1-9(2)12-8-13(21-7)10(3)14-15(12)17(22-11(4)19)18(5,6)16(14)20/h8-9,17H,1-7H3
InChIKey FCVOUXXKDAWLER-UHFFFAOYSA-N
Mol Weight 304.39 g/mol
Molecular Formula C18H24O4
Exact Mass 304.167459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BZYmsvAlUi
Name (5-methoxy-2,2,4-trimethyl-3-oxidanylidene-7-propan-2-yl-1H-inden-1-yl) ethanoate
CAS Registry Number 116173-39-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O4
InChI InChI=1S/C18H24O4/c1-9(2)12-8-13(21-7)10(3)14-15(12)17(22-11(4)19)18(5,6)16(14)20/h8-9,17H,1-7H3
InChIKey FCVOUXXKDAWLER-UHFFFAOYSA-N
Molecular Weight 304.386 g/mol
SMILES C1(C(C(OC(=O)C)c2c1c(c(cc2C(C)C)OC)C)(C)C)=O
SPLASH splash10-0007-1390000000-6a2ad5ed7e9e46614eea
Source of Spectrum B-41-369-5
Synonyms (5-methoxy-2,2,4-trimethyl-3-oxo-7-propan-2-yl-1H-inden-1-yl) acetate (7-isopropyl-5-methoxy-2,2,4-trimethyl-3-oxo-indan-1-yl) acetate Acetic acid (5-methoxy-2,2,4-trimethyl-3-oxo-7-propan-2-yl-1H-inden-1-yl) ester Acetic acid (7-isopropyl-3-keto-5-methoxy-2,2,4-trimethyl-indan-1-yl) ester
Wiley ID 1306566