(R)-2-Methyl-1,4-butanediol(22644-28-6) 13C NMR
Molecular FormulaC5H12O2
Molecular Weight104.15
InChIInChI=1S/C5H12O2/c1-5(4-7)2-3-6/h5-7H,2-4H2,1H3/t5-/m1/s1
InChIKey MWCBGWLCXSUTHK-RXMQYKEDSA-N
SmilesC(O)[C@H](C)CCO
-
![](https://www.chemicalbook.com/Spectrum/22644-28-6_MS.gif)
Mass
MS-IW-9083
(R)-(+)-2-methyl-1,4-butanediol
C5H12O2 (Mass of molecular ion: 104)
Source Temperature: 200 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
15.0 1.0
18.0 3.5
19.0 1.5
27.0 10.4
28.0 18.0
29.0 15.9
30.0 1.3
31.0 31.4
32.0 3.7
33.0 2.5
39.0 8.8
40.0 2.8
41.0 44.5
42.0 6.0
43.0 23.3
44.0 10.7
45.0 5.1
53.0 2.7
54.0 1.2
55.0 32.2
56.0 100.0
57.0 17.0
58.0 20.4
59.0 1.2
67.0 1.8
68.0 2.0
69.0 1.8
71.0 19.2
72.0 1.0
74.0 1.3
85.0 2.4
86.0 7.6
87.0 1.0