Gramine(87-52-5) IR1
Molecular FormulaC11H14N2
Molecular Weight174.24
InChIInChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3
InChIKey OCDGBSUVYYVKQZ-UHFFFAOYSA-N
SmilesN1C2=C(C=CC=C2)C(CN(C)C)=C1
-
MassMS-NW-0433 3-(dimethylaminomethyl)indole C11H14N2 (Mass of molecular ion: 174)
Source Temperature: 140 °C Sample Temperature: 120 °C Direct, 75 eV
15.0 1.2 28.0 1.4 39.0 1.0 42.0 3.0 44.0 11.0 45.0 3.4 50.0 1.0 51.0 2.1 57.0 1.3 58.0 1.6 75.0 1.1 76.0 1.8 77.0 5.6 78.0 1.1 87.0 1.6 102.0 4.9 103.0 5.1 128.0 2.4 129.0 11.7 130.0 100.0 131.0 23.1 132.0 2.5 157.0 1.3 173.0 5.5 174.0 46.9 175.0 6.0
in CDCl3
KBr disc
nujol mull
