Name | Value |
---|---|
InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1 | |
C22H25NO6 | |
399.16818752000006 | |
O=C1C=C2C(=CC=C1OC)C3=C(OC)C(OC)=C(OC)C=C3CCC2N=C(O)C | |
IAKHMKGGTNLKSZ-INIZCTEOSA-N |
Name | Value |
---|---|
LC-ESI | |
Commercial | |
Orbitrap | |
399.168 | |
1 | |
MSV0000083472_NIH_NP_QE_Pos2_0i1min_r80_mergeMSMS.mgf | |
MS2 | |
GNPS-NIH-NATURALPRODUCTSLIBRARY_ROUND2_POSITIVE | |
Pieter Dorrestein, mpanitchpakdi, lfnothias/robinschmid | |
positive | |
3.0567431998750947 | |
0.689882551829512 | |
400.176 | |
[M+H]+ | |
0.3936268043884784 ppm | |
-1.5752000007296374E-4 Da |