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(1S*,3S*,4S*,8R*)-3-methyltricyclo[6.3.0.0(1,4)]undecan-5-en-5-yl Acetate
SpectraBase Compound ID 2sneZgKi0be
InChI InChI=1S/C14H20O2/c1-9-8-14-7-3-4-11(14)5-6-12(13(9)14)16-10(2)15/h6,9,11,13H,3-5,7-8H2,1-2H3/t9-,11+,13+,14-/m0/s1
InChIKey RPEWFGCBGSUDOG-FRJFDASCSA-N
Mol Weight 220.31 g/mol
Molecular Formula C14H20O2
Exact Mass 220.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTqlainhHTu
Name (1S*,3S*,4S*,8R*)-3-methyltricyclo[6.3.0.0(1,4)]undecan-5-en-5-yl Acetate
Alternate Name(s) (2S,2aS,5aR,8aS)-2-methyl-1,2,2a,5,5a,6,7,8-octahydrocyclobuta[d]inden-3-yl acetate
CAS Registry Number 137946-55-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O2
InChI InChI=1S/C14H20O2/c1-9-8-14-7-3-4-11(14)5-6-12(13(9)14)16-10(2)15/h6,9,11,13H,3-5,7-8H2,1-2H3/t9-,11+,13+,14-/m0/s1
InChIKey RPEWFGCBGSUDOG-FRJFDASCSA-N
Molecular Weight 220.312 g/mol
SMILES [C@]123[C@](C(OC(=O)C)=CC[C@]3(CCC1)[H])([H])[C@](C2)(C)[H]
SPLASH splash10-000i-0900000000-cf04c998d37628166169
Source of Spectrum J-57-1023-13
Wiley ID 1220287