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2-Pentalenecarboxylic acid, octahydro-1,3a,4,6a-tetramethyl-2-(2-propenyl)-, methyl ester, (1.alpha.,2.alpha.,3a.alpha.,4.alpha.,6a.a lpha.)-(.+-.)-

View entire compound with spectra: 2 MS (GC)

2-Pentalenecarboxylic acid, octahydro-1,3a,4,6a-tetramethyl-2-(2-propenyl)-, methyl ester, (1.alpha.,2.alpha.,3a.alpha.,4.alpha.,6a.a lpha.)-(.+-.)-
SpectraBase Compound ID 8wObY3rJrFe
InChI InChI=1S/C17H28O2/c1-7-9-17(14(18)19-6)11-16(5)12(2)8-10-15(16,4)13(17)3/h7,12-13H,1,8-11H2,2-6H3
InChIKey KGEJHVZJZMZTJC-UHFFFAOYSA-N
Mol Weight 264.41 g/mol
Molecular Formula C17H28O2
Exact Mass 264.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83eJ8HGPZ1G
Name 2-Pentalenecarboxylic acid, octahydro-1,3a,4,6a-tetramethyl-2-(2-propenyl)-, methyl ester, (1.alpha.,2.alpha.,3a.alpha.,4.alpha.,6a.a lpha.)-(.+-.)-
CAS Registry Number 116214-99-4
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O2
InChI InChI=1S/C17H28O2/c1-7-9-17(14(18)19-6)11-16(5)12(2)8-10-15(16,4)13(17)3/h7,12-13H,1,8-11H2,2-6H3
InChIKey KGEJHVZJZMZTJC-UHFFFAOYSA-N
Molecular Weight 264.409 g/mol
SMILES C12(C(CC(C2C)(C(=O)OC)CC=C)(C(C)CC1)C)C
SPLASH splash10-006t-2920000000-b7f514025495dc32e8ed
Source of Spectrum F-43-4883-11
Synonyms Methyl (1RS,2RS,3SR,5RS,6SR)-1,2,5,6-tetramethyl-3-2'-propenylbicyclo[3.3.0]octan-3-carboxylate Methyl (1RS,2RS,3RS,5RS,6SR)-1,2,5,6-tetramethyl-3-2'-propenylbicyclo[3.3.0]octan-3-carboxylate Methyl 2-allyl-1,3a,4,6a-tetramethyloctahydro-2-pentalenecarboxylate
Wiley ID 1268451