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Isoquinoline, 3-butyl-

View entire compound with spectra: 2 MS (GC)

Isoquinoline, 3-butyl-
SpectraBase Compound ID 6mAZY12zIVh
InChI InChI=1S/C13H15N/c1-2-3-8-13-9-11-6-4-5-7-12(11)10-14-13/h4-7,9-10H,2-3,8H2,1H3
InChIKey OKQPDIASPWSCFS-UHFFFAOYSA-N
Mol Weight 185.27 g/mol
Molecular Formula C13H15N
Exact Mass 185.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Icv4TrS4Yno
Name Isoquinoline, 3-butyl-
Alternate Name(s) 3-Butylisoquinoline
CAS Registry Number 7661-42-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15N
InChI InChI=1S/C13H15N/c1-2-3-8-13-9-11-6-4-5-7-12(11)10-14-13/h4-7,9-10H,2-3,8H2,1H3
InChIKey OKQPDIASPWSCFS-UHFFFAOYSA-N
Molecular Weight 185.270 g/mol
SMILES CCCCc1cc2ccccc2cn1
SPLASH splash10-0006-1900000000-4835c92a75193644ac41
Source of Spectrum W5-1989-47184-18352
Wiley ID 1182103