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Protoconstipatic acid
SpectraBase Compound ID 9neJqZmg4Dl
InChI InChI=1S/C21H36O5/c1-16(22)14-12-10-8-6-4-3-5-7-9-11-13-15-18-19(20(23)24)17(2)21(25)26-18/h16,18-19,22H,2-15H2,1H3,(H,23,24)
InChIKey UYUDMGMNHAKPEV-UHFFFAOYSA-N
Mol Weight 368.5 g/mol
Molecular Formula C21H36O5
Exact Mass 368.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Tkj2uJOi1J
Name Protoconstipatic acid
CAS Registry Number 73036-29-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O5
InChI InChI=1S/C21H36O5/c1-16(22)14-12-10-8-6-4-3-5-7-9-11-13-15-18-19(20(23)24)17(2)21(25)26-18/h16,18-19,22H,2-15H2,1H3,(H,23,24)
InChIKey UYUDMGMNHAKPEV-UHFFFAOYSA-N
Molecular Weight 368.514 g/mol
SMILES OC(CCCCCCCCCCCCCC1OC(C(C1C(=O)O)=C)=O)C
SPLASH splash10-0a6u-9312000000-0618a55c4db4b43b9fd0
Source of Spectrum B-32-2568-0
Wiley ID 1353161