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4,6,8-Isoquinolinetriol, 1,2,3,4-tetrahydro-, hydrochloride

View entire compound with spectra: 1 MS (GC)

4,6,8-Isoquinolinetriol, 1,2,3,4-tetrahydro-, hydrochloride
SpectraBase Compound ID 9JSZXHxsF0o
InChI InChI=1S/C9H11NO3/c11-5-1-6-7(8(12)2-5)3-10-4-9(6)13/h1-2,9-13H,3-4H2
InChIKey SSJHGWJCKZYGCK-UHFFFAOYSA-N
Mol Weight 181.19 g/mol
Molecular Formula C9H11NO3
Exact Mass 181.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AKiGy0Mstc
Name 4,6,8-Isoquinolinetriol, 1,2,3,4-tetrahydro-, hydrochloride
CAS Registry Number 72511-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO3
InChI InChI=1S/C9H11NO3/c11-5-1-6-7(8(12)2-5)3-10-4-9(6)13/h1-2,9-13H,3-4H2
InChIKey SSJHGWJCKZYGCK-UHFFFAOYSA-N
Molecular Weight 181.191 g/mol
SMILES Oc1cc(cc2c1CNCC2O)O
SPLASH splash10-0udi-0900000000-9716934ad0a12c9cd9da
Source of Spectrum B-32-1325-0
Synonyms 1,2,3,4-tetrahydro-4,6,8-isoquinolinetriol 4,6,8-Isoquinolinetriol, 1,2,3,4-tetrahydro- 4,6,8-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Wiley ID 1177382