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3,4-dihydroisoquinoline
SpectraBase Compound ID Dr4iZQKhkFf
InChI InChI=1S/C9H9N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4,7H,5-6H2
InChIKey NKSZCPBUWGZONP-UHFFFAOYSA-N
Mol Weight 131.18 g/mol
Molecular Formula C9H9N
Exact Mass 131.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5oHa5s4j6GB
Name Isoquinoline, 3,4-dihydro-
Alternate Name(s) 3,4-Dihydro-isoquinoline EINECS 221-769-0
CAS Registry Number 3230-65-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N
InChI InChI=1S/C9H9N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4,7H,5-6H2
InChIKey NKSZCPBUWGZONP-UHFFFAOYSA-N
Molecular Weight 131.178 g/mol
SMILES C1=NCCc2ccccc12
SPLASH splash10-001i-0900000000-5dec931051c8a5670071
Source of Spectrum SO-1974-288-2
Wiley ID 1536836