Name | Value |
---|---|
C16H22O7 | |
326.136553044 | |
O=C(OC1C=CC(O)C(OC(=O)C)CCC(=O)OC1C)C=CC | |
InChI=1S/C16H22O7/c1-4-5-15(19)23-13-7-6-12(18)14(22-11(3)17)8-9-16(20)21-10(13)2/h4-7,10,12-14,18H,8-9H2,1-3H3/b5-4+,7-6? | |
GXBAKQFLYWSOJH-DBYMJTHYSA-N |
Name | Value |
---|---|
MS2 | |
C16H22O7 | |
326.136553 | |
3.976611042 | |
2.1206796169281006 | |
hcd_lib.msp | |
positive | |
2.120679527472205 | |
0.667288737283605 | |
349.125771 | |
[M+Na]+ | |
1.5812181336130846 ppm | |
-5.520440000168492E-4 Da |