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Naphthaleneacetic acid, 1,2,3,4,4a,5,6,7-octahydro-4a,8-dimethyl-.alpha.-methylene-, methyl ester, cis-
SpectraBase Compound ID 7KPv7lxgmO5
InChI InChI=1S/C16H24O2/c1-11-7-5-9-16(3)10-6-8-13(14(11)16)12(2)15(17)18-4/h13H,2,5-10H2,1,3-4H3/t13-,16+/m1/s1
InChIKey NYQLBYAOGXJTCG-CJNGLKHVSA-N
Mol Weight 248.37 g/mol
Molecular Formula C16H24O2
Exact Mass 248.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dHDwQzqVJx
Name Naphthaleneacetic acid, 1,2,3,4,4a,5,6,7-octahydro-4a,8-dimethyl-.alpha.-methylene-, methyl ester, cis-
Alternate Name(s) 2,6b-dimethyl-9b-(.alpha.-methoxycarbonylvinyl)bicyclo(4.4.0)dec-1-ene or methyl ester ofisocostussic acid Methyl 2-[(1S,4aR)-4a,8-dimethyl-1,2,3,4,4a,5,6,7-octahydro-1-naphthalenyl]acrylate Methyl ester of isocostic acid
CAS Registry Number 62458-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O2
InChI InChI=1S/C16H24O2/c1-11-7-5-9-16(3)10-6-8-13(14(11)16)12(2)15(17)18-4/h13H,2,5-10H2,1,3-4H3/t13-,16+/m1/s1
InChIKey NYQLBYAOGXJTCG-CJNGLKHVSA-N
Molecular Weight 248.366 g/mol
SMILES C=12[C@@](C(C(=O)OC)=C)(CCC[C@@]2(CCCC1C)C)[H]
SPLASH splash10-001j-0090000000-febb96d9fe1d461e5a14
Source of Spectrum K-110-313-0
Wiley ID 1251605