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1-(1-phenylethenyl)-4,5-cis-di(methoxycarbonyl)cyclohexene
SpectraBase Compound ID FD6I2pES1lb
InChI InChI=1S/C18H20O4/c1-12(13-7-5-4-6-8-13)14-9-10-15(17(19)21-2)16(11-14)18(20)22-3/h4-9,15-16H,1,10-11H2,2-3H3/t15-,16+/m0/s1
InChIKey QCQDAHSWOBHAHH-JKSUJKDBSA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2R4AYsitTKi
Name 1-(1-phenylethenyl)-4,5-cis-di(methoxycarbonyl)cyclohexene
CAS Registry Number 107146-75-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-12(13-7-5-4-6-8-13)14-9-10-15(17(19)21-2)16(11-14)18(20)22-3/h4-9,15-16H,1,10-11H2,2-3H3/t15-,16+/m0/s1
InChIKey QCQDAHSWOBHAHH-JKSUJKDBSA-N
Molecular Weight 300.354 g/mol
SMILES C=1(C[C@@](C(=O)OC)([C@](CC1)(C(=O)OC)[H])[H])C(c1ccccc1)=C
SPLASH splash10-0uec-0942000000-317226f02ec9ec848eff
Source of Spectrum AJ-59-2456-11
Synonyms Dimethyl (1S,2R)-4-(1-phenylvinyl)-4-cyclohexene-1,2-dicarboxylate
Wiley ID 1303062