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Isoquinoline
SpectraBase Compound ID CEvmZr1lIK2
InChI InChI=1S/C9H7N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-7H
InChIKey AWJUIBRHMBBTKR-UHFFFAOYSA-N
Mol Weight 129.16 g/mol
Molecular Formula C9H7N
Exact Mass 129.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3my3zJDfEG
Name Isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N
InChI InChI=1S/C9H7N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-7H
InChIKey AWJUIBRHMBBTKR-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 129.162 g/mol
SMILES c1ccc2c(c1)ccnc2
SPLASH splash10-004i-5900000000-0f34247cbff45a31a042
Source of Spectrum SRH-2022-9036-0
Wiley ID 1830708