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(4S,5S,6R)-6-Methyl-5-nitro-4-(2-chlorophenyl)cyclohex-1-enecarbaldehyde
SpectraBase Compound ID BzzOj4VlQh6
InChI InChI=1S/C14H14ClNO3/c1-9-10(8-17)6-7-12(14(9)16(18)19)11-4-2-3-5-13(11)15/h2-6,8-9,12,14H,7H2,1H3/t9-,12+,14+/m1/s1
InChIKey IKAOWTVHJNTTCX-LQJRIPTKSA-N
Mol Weight 279.72 g/mol
Molecular Formula C14H14ClNO3
Exact Mass 279.066221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FCJoum8rgd
Name (4S,5S,6R)-6-Methyl-5-nitro-4-(2-chlorophenyl)cyclohex-1-enecarbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClNO3
InChI InChI=1S/C14H14ClNO3/c1-9-10(8-17)6-7-12(14(9)16(18)19)11-4-2-3-5-13(11)15/h2-6,8-9,12,14H,7H2,1H3/t9-,12+,14+/m1/s1
InChIKey IKAOWTVHJNTTCX-LQJRIPTKSA-N
Molecular Weight 279.723 g/mol
SMILES [C@]1(N(=O)=O)([C@](c2c(Cl)cccc2)(CC=C([C@]1(C)[H])C=O)[H])[H]
SPLASH splash10-0fb9-2940000000-cde02e6754c1be6c0e3a
Source of Spectrum F4-42-570-3b
Wiley ID 1673613