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Cyclohexanecarboxylic acid, 2-[(phenylmethylene)amino]-, methyl ester, cis-(.+-.)-
SpectraBase Compound ID FxlO868NvlX
InChI InChI=1S/C15H19NO2/c1-18-15(17)13-9-5-6-10-14(13)16-11-12-7-3-2-4-8-12/h2-4,7-8,11,13-14H,5-6,9-10H2,1H3/b16-11+/t13-,14+/m1/s1
InChIKey DIVGVMHTTLOBRH-WAWJYGGWSA-N
Mol Weight 245.32 g/mol
Molecular Formula C15H19NO2
Exact Mass 245.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IMEV7xMyVIU
Name Cyclohexanecarboxylic acid, 2-[(phenylmethylene)amino]-, methyl ester, cis-(.+-.)-
CAS Registry Number 107313-13-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H19NO2
InChI InChI=1S/C15H19NO2/c1-18-15(17)13-9-5-6-10-14(13)16-11-12-7-3-2-4-8-12/h2-4,7-8,11,13-14H,5-6,9-10H2,1H3/b16-11+/t13-,14+/m1/s1
InChIKey DIVGVMHTTLOBRH-WAWJYGGWSA-N
Molecular Weight 245.322 g/mol
SMILES [C@@]1(C(=O)OC)([C@@](\N=C\c2ccccc2)(CCCC1)[H])[H]
SPLASH splash10-0k9x-3930000000-c5fa1b5bb6bee5ca8955
Source of Spectrum B-39-598-14
Synonyms Methyl (1R,2S)-2-{[(E)-phenylmethylidene]amino}cyclohexanecarboxylate Methyl cis-2-benzylideneaminocyclohexanecarboxylate
Wiley ID 1248109