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(2E)-4-(1H-indol-4-yl)-1,1-dideutero-2-methyl-2-butenyl acetate
SpectraBase Compound ID 57NvcoWW8dU
InChI InChI=1S/C15H17NO2/c1-11(10-18-12(2)17)6-7-13-4-3-5-15-14(13)8-9-16-15/h3-6,8-9,16H,7,10H2,1-2H3/b11-6+/i10D2
InChIKey ONAGMNWQCQVZKT-QRDLXZQUSA-N
Mol Weight 245.32 g/mol
Molecular Formula C15H152D2NO2
Exact Mass 245.138482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K00bOOPYy2O
Name (2E)-4-(1H-indol-4-yl)-1,1-dideutero-2-methyl-2-butenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15D2NO2
InChI InChI=1S/C15H17NO2/c1-11(10-18-12(2)17)6-7-13-4-3-5-15-14(13)8-9-16-15/h3-6,8-9,16H,7,10H2,1-2H3/b11-6+/i10D2
InChIKey ONAGMNWQCQVZKT-QRDLXZQUSA-N
Molecular Weight 245.318 g/mol
SMILES [nH]1ccc2c1cccc2C\C=C/(C)C(OC(=O)C)([2D])[2D]
SPLASH splash10-00e9-2900000000-d72770459ddfeab03eba
Synonyms 4-(1H-indol-4-yl)-2-methyl-2-butenyl acetate
Wiley ID 1481796