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3-(4',5',6',7'-Tetrahydroisoindol-1'-yl)acrolein
SpectraBase Compound ID CW5WUk8pZLw
InChI InChI=1S/C11H13NO/c13-7-3-6-11-10-5-2-1-4-9(10)8-12-11/h3,6-8,12H,1-2,4-5H2/b6-3+
InChIKey NOTHGBVGVJJUDU-ZZXKWVIFSA-N
Mol Weight 175.23 g/mol
Molecular Formula C11H13NO
Exact Mass 175.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZVg1G8llvR
Name 3-(4',5',6',7'-Tetrahydroisoindol-1'-yl)acrolein
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13NO
InChI InChI=1S/C11H13NO/c13-7-3-6-11-10-5-2-1-4-9(10)8-12-11/h3,6-8,12H,1-2,4-5H2/b6-3+
InChIKey NOTHGBVGVJJUDU-ZZXKWVIFSA-N
Molecular Weight 175.231 g/mol
SMILES [nH]1cc2CCCCc2c1\C=C\C=O
SPLASH splash10-0a6s-2900000000-25aff39bd45eec6dba07
Source of Spectrum U-1994-507-10
Synonyms (2E)-3-(4,5,6,7-tetrahydro-2H-isoindol-1-yl)-2-propenal
Wiley ID 765799