1-羥基異喹啉(491-30-5)質(zhì)譜(MS)
InChI:InChI=1S/C9H7NO/c11-9-8-4-2-1-3-7(8)5-6-10-9/h1-6H,(H,10,11)
InChIKey: VDBNYAPERZTOOF-UHFFFAOYSA-N
Smiles:C1(=O)C2=C(C=CC=C2)C=CN1
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Assign. Shift(ppm)
A 11.
B 8.240
C 7.711
D 7.674
E 7.512
F 7.218
G 6.577
J(F,G)=7.1HZ.
Spectral Code: 1H NMR : 400 MHz in DMSO-d6