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2,5-Cyclohexadiene-1-carboxylic acid, 2-methyl-4-(1H-pyrrol-2-yl)-, cis-
SpectraBase Compound ID 8eYFvTmBWrS
InChI InChI=1S/C12H13NO2/c1-8-7-9(11-3-2-6-13-11)4-5-10(8)12(14)15/h2-7,9-10,13H,1H3,(H,14,15)/t9-,10+/m0/s1
InChIKey ROKIGFAOHCHRHX-VHSXEESVSA-N
Mol Weight 203.24 g/mol
Molecular Formula C12H13NO2
Exact Mass 203.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1lB0drB1Tw
Name 2,5-Cyclohexadiene-1-carboxylic acid, 2-methyl-4-(1H-pyrrol-2-yl)-, cis-
CAS Registry Number 73794-65-7
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO2
InChI InChI=1S/C12H13NO2/c1-8-7-9(11-3-2-6-13-11)4-5-10(8)12(14)15/h2-7,9-10,13H,1H3,(H,14,15)/t9-,10+/m0/s1
InChIKey ROKIGFAOHCHRHX-VHSXEESVSA-N
Molecular Weight 203.241 g/mol
SMILES [nH]1cccc1[C@]1(C=C[C@@](C(=O)O)(C(=C1)C)[H])[H]
SPLASH splash10-0a4l-5910000000-e221711780f31eaddc68
Source of Spectrum K-114-3152-0
Wiley ID 1200829