For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-Ethyl-1,7-dimethyl-3,4-benzobicyclo[4.1.0]hept-3-en-2-one
SpectraBase Compound ID KOBaEsRD7gK
InChI InChI=1S/C15H18O/c1-4-10-11-7-5-6-8-12(11)14(16)15(3)9(2)13(10)15/h5-10,13H,4H2,1-3H3/t9?,10?,13-,15-/m0/s1
InChIKey CLLYKAVEZGRRTJ-NDQGGDCISA-N
Mol Weight 214.31 g/mol
Molecular Formula C15H18O
Exact Mass 214.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B62EmOvoPfm
Name 5-Ethyl-1,7-dimethyl-3,4-benzobicyclo[4.1.0]hept-3-en-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O
InChI InChI=1S/C15H18O/c1-4-10-11-7-5-6-8-12(11)14(16)15(3)9(2)13(10)15/h5-10,13H,4H2,1-3H3/t9?,10?,13-,15-/m0/s1
InChIKey CLLYKAVEZGRRTJ-NDQGGDCISA-N
Molecular Weight 214.308 g/mol
SMILES [C@]12([C@](C(CC)c3c(C2=O)cccc3)(C1C)[H])C
SPLASH splash10-000i-0910000000-dda68b3c91ed71a28063
Source of Spectrum J-58-2803-23
Synonyms (1aS,7aS)-2-Ethyl-1,7a-dimethyl-1,1a,2,7a-tetrahydro-cyclopropa[b]naphthalen-7-one 7-ethyl-1,1a-dimethyl-1,1a,7,7a-tetrahydro-2H-cyclopropa[b]naphthalen-2-one
Wiley ID 1214199