三蝶烯(477-75-8)核磁圖(13CNMR)
InChI:InChI=1S/C20H14/c1-2-8-14-13(7-1)19-15-9-3-5-11-17(15)20(14)18-12-6-4-10-16(18)19/h1-12,19-20H
InChIKey: NGDCLPXRKSWRPY-UHFFFAOYSA-N
Smiles:C12C3=CC=CC=C3C(C3=CC=CC=C13)C1=CC=CC=C21
-
Mass
MS-NW-8569
triptycene
C20H14 (Mass of molecular ion: 254)
Source Temperature: 180 °C
Sample Temperature: 120 °C
Direct, 75 eV
100.0 1.6
101.0 1.4
112.0 3.0
112.5 1.6
113.0 8.4
113.5 1.8
114.0 1.8
119.5 5.3
120.0 1.1
124.0 1.5
124.5 1.3
125.0 7.5
125.5 2.7
126.0 19.6
126.5 8.0
127.0 5.5
127.5 1.0
151.0 1.2
152.0 1.2
176.0 2.5
177.0 1.2
178.0 2.9
224.0 1.9
225.0 1.4
226.0 2.9
239.0 3.8
248.0 1.3
249.0 1.3
250.0 11.2
251.0 5.4
252.0 39.4
253.0 87.3
254.0 100.0
255.0 19.7
256.0 2.0