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14-nor-Isoagath-12-en-14-one
SpectraBase Compound ID 5mBoBxj6czo
InChI InChI=1S/C19H30O/c1-13-7-8-15-18(4)11-6-10-17(2,3)14(18)9-12-19(15,5)16(13)20/h7,14-15H,6,8-12H2,1-5H3/t14?,15?,18-,19+/m0/s1
InChIKey CVJBWVSCSYHXJI-QIRNKGDASA-N
Mol Weight 274.45 g/mol
Molecular Formula C19H30O
Exact Mass 274.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GG29a7erPrr
Name 14-nor-Isoagath-12-en-14-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O
InChI InChI=1S/C19H30O/c1-13-7-8-15-18(4)11-6-10-17(2,3)14(18)9-12-19(15,5)16(13)20/h7,14-15H,6,8-12H2,1-5H3/t14?,15?,18-,19+/m0/s1
InChIKey CVJBWVSCSYHXJI-QIRNKGDASA-N
Molecular Weight 274.448 g/mol
SMILES [C@]12(C([C@]3(CCCC(C3CC2)(C)C)C)CC=C(C1=O)C)C
SPLASH splash10-00di-3970000000-2e89f70de10c2f791827
Source of Spectrum X4-20-689-0
Wiley ID 1585748