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1,5,11-Cyclotetradecatriene-1-carboxylic acid, 8-(1-hydroxy-1-methylethyl)-5,11-dimethyl-, [R-(E,Z,Z)]-
SpectraBase Compound ID 26iqIZDsY1g
InChI InChI=1S/C20H32O3/c1-15-7-5-9-17(19(21)22)10-6-8-16(2)12-14-18(13-11-15)20(3,4)23/h7,10,12,18,23H,5-6,8-9,11,13-14H2,1-4H3,(H,21,22)/b15-7-,16-12-,17-10+/t18-/m1/s1
InChIKey GVWSMQKNQGVTAK-RFMQOLPOSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9f016CZ9ad3
Name 1,5,11-Cyclotetradecatriene-1-carboxylic acid, 8-(1-hydroxy-1-methylethyl)-5,11-dimethyl-, [R-(E,Z,Z)]-
Alternate Name(s) (8R)-8-(1-hydroxy-1-methylethyl)-5,11-dimethyl-1,5,11-cyclotetradecatriene-1-carboxylic acid 1-(1-Hydroxy-isopropyl)-4,12-dimethyl-8-hydroxylcarbonyl-cyclotetradeca-4,8,12-triene
CAS Registry Number 105608-36-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-15-7-5-9-17(19(21)22)10-6-8-16(2)12-14-18(13-11-15)20(3,4)23/h7,10,12,18,23H,5-6,8-9,11,13-14H2,1-4H3,(H,21,22)/b15-7-,16-12-,17-10+/t18-/m1/s1
InChIKey GVWSMQKNQGVTAK-RFMQOLPOSA-N
Molecular Weight 320.473 g/mol
SMILES OC([C@]1(C\C=C/(CC\C=C\(C(=O)O)CC\C=C/(CC1)C)C)[H])(C)C
SPLASH splash10-0fe0-0945000000-f92440017fd27fd55916
Source of Spectrum B-39-1707-3
Wiley ID 1320419