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1,4-Pentadien-3-ol, 1-[5-(4-hydroxy-3-methyl-2-butenyl)-2,6,6-trimethyl-1-cyclohexen-1-yl]-3-methyl-
SpectraBase Compound ID HOQoD43bRPn
InChI InChI=1S/C20H32O2/c1-7-20(6,22)13-12-18-16(3)9-11-17(19(18,4)5)10-8-15(2)14-21/h7-8,12-13,17,21-22H,1,9-11,14H2,2-6H3/b13-12+,15-8+/t17-,20?/m0/s1
InChIKey MGNPUUAERCJJJS-LSTCNHKTSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2K0C03JcffJ
Name 1,4-Pentadien-3-ol, 1-[5-(4-hydroxy-3-methyl-2-butenyl)-2,6,6-trimethyl-1-cyclohexen-1-yl]-3-methyl-
CAS Registry Number 99647-33-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-7-20(6,22)13-12-18-16(3)9-11-17(19(18,4)5)10-8-15(2)14-21/h7-8,12-13,17,21-22H,1,9-11,14H2,2-6H3/b13-12+,15-8+/t17-,20?/m0/s1
InChIKey MGNPUUAERCJJJS-LSTCNHKTSA-N
Molecular Weight 304.474 g/mol
SMILES OC\C(=C\C[C@@]1(C(C(\C=C\C(C=C)(O)C)=C(CC1)C)(C)C)[H])C
SPLASH splash10-0006-9300000000-e2ec42dcecd7443502cd
Source of Spectrum H-69-656-0
Synonyms (1E)-1-{(5R)-5-[(2E)-4-hydroxy-3-methyl-2-butenyl]-2,6,6-trimethyl-1-cyclohexen-1-yl}-3-methyl-1,4-pentadien-3-ol 1-[(5'R)-5'-(4''-hydroxy-3''-methyl-2''-butenyl)2',6',6'-trimethyl-1'-cyclohexenyl]-3-methyl-1,4-pentadien-3-ol
Wiley ID 1306905