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iodoasterone
SpectraBase Compound ID GleFhV4UCfz
InChI InChI=1S/C19H29IO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3/t12?,13-,14-,15-,16-,18-,19-/m0/s1
InChIKey OVPOFQLHKQFQRE-QRIARFFBSA-N
Mol Weight 400.34 g/mol
Molecular Formula C19H29IO
Exact Mass 400.126311 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6EcPoNE7nxh
Name iodoasterone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29IO
InChI InChI=1S/C19H29IO/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16H,3-11H2,1-2H3/t12?,13-,14-,15-,16-,18-,19-/m0/s1
InChIKey OVPOFQLHKQFQRE-QRIARFFBSA-N
Ionization Type EI
Molecular Weight 400.344 g/mol
SMILES C1C[C@]2(C(C[C@]1(I)[H])CC[C@@]1([C@@]2(CC[C@]2([C@]1(CCC2=O)[H])C)[H])[H])C
SPLASH splash10-0300-0490000000-a01ad297e87d648a361a
Source of Spectrum CN114716296A
Wiley ID 1884333