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cis-Ferruginol acetate
SpectraBase Compound ID 42xIULm7rMD
InChI InChI=1S/C22H32O2/c1-14(2)17-12-16-8-9-20-21(4,5)10-7-11-22(20,6)18(16)13-19(17)24-15(3)23/h12-14,20H,7-11H2,1-6H3/t20-,22-/m1/s1
InChIKey AZEPENWNEVUZPW-IFMALSPDSA-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 KgUIyJeAkzY
Name cis-Ferruginol acetate
CAS Registry Number 126061-37-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C22H32O2/c1-14(2)17-12-16-8-9-20-21(4,5)10-7-11-22(20,6)18(16)13-19(17)24-15(3)23/h12-14,20H,7-11H2,1-6H3/t20-,22-/m1/s1
InChIKey AZEPENWNEVUZPW-IFMALSPDSA-N
Molecular Weight 328.496 g/mol
SMILES CC(=O)Oc1c(cc2c(c1)[C@@]1([C@](CC2)(C(CCC1)(C)C)[H])C)C(C)C
SPLASH splash10-000l-7980000000-2105bd0a59779c1bec3c
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Ferruginol acetate
Wiley ID 1886350