Name | Value |
---|---|
C19H25N3O6 | |
391.17433552 | |
O=C1C(=CN(C(=O)N1CCCC(O)C=2C=NC=CC2)C3OC(CO)C(O)C3)C | |
InChI=1S/C19H25N3O6/c1-12-10-22(17-8-15(25)16(11-23)28-17)19(27)21(18(12)26)7-3-5-14(24)13-4-2-6-20-9-13/h2,4,6,9-10,14-17,23-25H,3,5,7-8,11H2,1H3/t14?,15-,16+,17+/m0/s1 | |
IHIGMPURTZNWED-GYXHSTLNSA-N |
Name | Value |
---|---|
ESI-ITFT | |
LTQ Orbitrap Fusion Tribrid, Thermo Scientfic | |
cid | |
40 | |
C19H25N3O6 | |
2 | |
20231130_DNA-Adduct_CombinedDB.msp | |
0.9671469843794782 | |
0.8803351230960542 | |
positive | |
392.181615661 | |
[M+H]+ | |
1.7590294201162493 ppm | |
-6.898589999764226E-4 Da |