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3a(1H)-Pentaleneacetic acid, hexahydro-6a-(phenylazo)-, ethyl ester
SpectraBase Compound ID 8u5pSLa5ujE
InChI InChI=1S/C18H24N2O2/c1-2-22-16(21)14-17-10-6-12-18(17,13-7-11-17)20-19-15-8-4-3-5-9-15/h3-5,8-9H,2,6-7,10-14H2,1H3/b20-19+
InChIKey QFFODLHDKAFAHO-FMQUCBEESA-N
Mol Weight 300.4 g/mol
Molecular Formula C18H24N2O2
Exact Mass 300.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDtNyykNuLt
Name 3a(1H)-Pentaleneacetic acid, hexahydro-6a-(phenylazo)-, ethyl ester
CAS Registry Number 108583-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24N2O2
InChI InChI=1S/C18H24N2O2/c1-2-22-16(21)14-17-10-6-12-18(17,13-7-11-17)20-19-15-8-4-3-5-9-15/h3-5,8-9H,2,6-7,10-14H2,1H3/b20-19+
InChIKey QFFODLHDKAFAHO-FMQUCBEESA-N
Molecular Weight 300.402 g/mol
SMILES C12(C(\N=N\c3ccccc3)(CCC1)CCC2)CC(=O)OCC
SPLASH splash10-056u-9500000000-c3fd239fb64f865151fa
Source of Spectrum F-42-5087-13
Synonyms 1-Phenylazo-5-ethoxycarbonylmethyl-bicyclo[3.3.0]octane Ethyl (6a-[(E)-phenyldiazenyl]hexahydro-3a(1H)-pentalenyl)acetate
Wiley ID 1303129