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Isoquinoline-1-D, 2-acetyl-1,2,3,4-tetrahydro-1-d-
SpectraBase Compound ID CuV3t5NL4oG
InChI InChI=1S/C11H13NO/c1-9(13)12-7-6-10-4-2-3-5-11(10)8-12/h2-5H,6-8H2,1H3/i8D2
InChIKey JBPPSLURCSFQDH-MGVXTIMCSA-N
Mol Weight 177.24 g/mol
Molecular Formula C11H11D2NO
Exact Mass 177.112268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjR7QaV2w76
Name Isoquinoline-1-D, 2-acetyl-1,2,3,4-tetrahydro-1-d-
Alternate Name(s) N-Acetyl-1,1-dideuterio-1,2,3,4-tetrahydroisoquinoline
CAS Registry Number 67519-07-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11D2NO
InChI InChI=1S/C11H13NO/c1-9(13)12-7-6-10-4-2-3-5-11(10)8-12/h2-5H,6-8H2,1H3/i8D2
InChIKey JBPPSLURCSFQDH-MGVXTIMCSA-N
Molecular Weight 177.243 g/mol
SMILES C(N1C(c2ccccc2CC1)([D])[D])(=O)C
SPLASH splash10-0ar0-3900000000-ff16ce194d8fd5b20aea
Source of Spectrum H-61-1747-0
Wiley ID 1171652