Spectrum MoNA018638 for trans-2-Octenoyl-carnitine; AIF; CE0; CorrDec

Rating: (*)(*)(*)(*)(*)

Compound Information

Chemical Names

Compound Metadata

NameValue
InChI=1S/C15H27NO4/c1-5-6-7-8-9-10-15(19)20-13(11-14(17)18)12-16(2,3)4/h9-10,13H,5-8,11-12H2,1-4H3/b10-9+/t13-/m1/s1
LOSHAHDSFZXVCT-WTNCMQEWSA-N
C15H27NO4
285.194008344
O=C(OC(CC(=O)[O-])C[N+](C)(C)C)C=CCCCCC

Mass Spectral Metadata

NameValue
2.492766
0
C15H27NO4
Centroid
Isabel Meister, Romanas Chaleckis
Agilent 6550 iFunnel
LC-ESI-QTOF
CC-BY
MS2
ESI
AIF
Merck SeQuant ZIC HILIC (2.1 x 100 mm, 3.5 µm particle size) with Merck SeQuant ZIC HILIC Guard column (2.1 mm x 2 mm, 3.5 µm particle size)
5/95 at 0-1.5 min, 60/40 at 12-14 min, 75/25 at 14.2-17 min; 5/95 at 18-25 min
0.3ml/min
water with 0.1% formic acid (pH2.7)
acetonitrile with 0.1% formic acid
POS_2020-06-11_V02-RCH_LC02_AIF_ChemSTD_Meister2020_OPEN.msp
positive
0.5743938115073814
0.5228357787657203
286.201293945313
[M+H]+
2.391319331757132 ppm
-0.0006843986869853325 Da