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Sandaracopimarinol
SpectraBase Compound ID KcHnwmAJnrz
InChI InChI=1S/C20H32O/c1-5-18(2)12-9-16-15(13-18)7-8-17-19(3,14-21)10-6-11-20(16,17)4/h5,13,16-17,21H,1,6-12,14H2,2-4H3/t16-,17-,18-,19-,20+/m0/s1
InChIKey JEOZUAHPKAVXSF-VYJAJWGXSA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eeFECMSdHw
Name Sandaracopimarinol
CAS Registry Number 24563-84-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 288.245315649 u
Formula C20H32O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C20H32O/c1-5-18(2)12-9-16-15(13-18)7-8-17-19(3,14-21)10-6-11-20(16,17)4/h5,13,16-17,21H,1,6-12,14H2,2-4H3/t16-,17-,18-,19-,20+/m0/s1
InChIKey JEOZUAHPKAVXSF-VYJAJWGXSA-N
Molecular Weight 288.475 g/mol
Nominal Mass 288 u
Number of Peaks 217
SMILES OC[C@@]1(CCC[C@]2([C@]1(CCC=1[C@@]2(CC[C@](C1)(C)C=C)[H])[H])C)C
SPLASH splash10-0a4l-7930000000-ee37b02aa77d983c371d
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001216