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

*Links on SpectraBase are not permalinks.
1-Pentalenecarboxylic acid, 3-(chloromethyl)octahydro-, methyl ester
SpectraBase Compound ID AtW7ujMZUl7
InChI InChI=1S/C11H17ClO2/c1-14-11(13)10-5-7(6-12)8-3-2-4-9(8)10/h7-10H,2-6H2,1H3
InChIKey KJWNFBGUUYMHIP-UHFFFAOYSA-N
Mol Weight 216.71 g/mol
Molecular Formula C11H17ClO2
Exact Mass 216.091707 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 DgHkQz0ymCj
Name 1-Pentalenecarboxylic acid, 3-(chloromethyl)octahydro-, methyl ester
CAS Registry Number 54815-17-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17ClO2
InChI InChI=1S/C11H17ClO2/c1-14-11(13)10-5-7(6-12)8-3-2-4-9(8)10/h7-10H,2-6H2,1H3
InChIKey KJWNFBGUUYMHIP-UHFFFAOYSA-N
Molecular Weight 216.708 g/mol
SMILES C(OC)(=O)C1C2C(CCC2)C(C1)CCl
SPLASH splash10-0adi-9600000000-a90cc2a00e2bcd24179f
Source of Spectrum AA-0-1536-1
Synonyms Methyl 3-(chloromethyl)octahydro-1-pentalenecarboxylate 3-(chloromethyl)-1,2,3,3a,4,5,6,6a-octahydropentalene-1-carboxylic acid methyl ester Methyl 3-(chloromethyl)-1,2,3,3a,4,5,6,6a-octahydropentalene-1-carboxylate Methyl 3-(chloromethyl)octahydropentalene-1-carboxylate
Wiley ID 27329