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A-homo-5-pregnene-4,20-dione
SpectraBase Compound ID 6NG4j0kxLlY
InChI InChI=1S/C22H32O2/c1-14(23)18-8-9-19-17-7-6-15-13-16(24)5-4-11-21(15,2)20(17)10-12-22(18,19)3/h6,17-20H,4-5,7-13H2,1-3H3/t17?,18-,19?,20?,21+,22-/m1/s1
InChIKey ARIUIGWOURYMLV-AXOWHWKQSA-N
Mol Weight 328.5 g/mol
Molecular Formula C22H32O2
Exact Mass 328.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4W4QhI7VzhG
Name A-homo-5-pregnene-4,20-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O2
InChI InChI=1S/C22H32O2/c1-14(23)18-8-9-19-17-7-6-15-13-16(24)5-4-11-21(15,2)20(17)10-12-22(18,19)3/h6,17-20H,4-5,7-13H2,1-3H3/t17?,18-,19?,20?,21+,22-/m1/s1
InChIKey ARIUIGWOURYMLV-AXOWHWKQSA-N
Molecular Weight 328.496 g/mol
SMILES [C@]12(C(C3C([C@@]4(C(CC(=O)CCC4)=CC3)C)CC1)CC[C@@]2(C(=O)C)[H])C
SPLASH splash10-0a73-9313000000-adbee1a8e5c60d66b751
Source of Spectrum F2-45-3068-16
Wiley ID 1689033