S-芐基巰基乙酸(103-46-8)紅外圖譜(IR2)
InChI:InChI=1S/C9H10O2S/c10-9(11)7-12-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)
InChIKey: AWLVTQRRKPBQEQ-UHFFFAOYSA-N
Smiles:C(O)(=O)CSCC1=CC=CC=C1
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Mass
MS-IW-6560
(benzylthio)acetic acid
C9H10O2S (Mass of molecular ion: 182)
Source Temperature: 130 °C
Sample Temperature: 110 °C
Direct, 75 eV
39.0 3.1
45.0 7.7
51.0 2.2
63.0 2.3
65.0 10.2
77.0 2.3
89.0 2.8
90.0 1.2
91.0 100.0
92.0 8.4
121.0 3.7
122.0 3.5
123.0 47.7
124.0 4.4
125.0 2.3
182.0 42.4
183.0 4.6
184.0 2.3