CID 203424

N-glycylglycyl-5-methoxytryptamine acetate

Structural Information

Molecular Formula
C15H20N4O3
SMILES
COC1=CC2=C(C=C1)NC=C2CCNC(=O)CNC(=O)CN
InChI
InChI=1S/C15H20N4O3/c1-22-11-2-3-13-12(6-11)10(8-18-13)4-5-17-15(21)9-19-14(20)7-16/h2-3,6,8,18H,4-5,7,9,16H2,1H3,(H,17,21)(H,19,20)
InChIKey
XWJKIIOGWZONJS-UHFFFAOYSA-N
Compound name
2-amino-N-[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-2-oxoethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.15353 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 305.16081 168.7
[M+Na]+ 327.14275 174.2
[M-H]- 303.14625 170.3
[M+NH4]+ 322.18735 183.3
[M+K]+ 343.11669 170.7
[M+H-H2O]+ 287.15079 160.7
[M+HCOO]- 349.15173 192.0
[M+CH3COO]- 363.16738 208.9
[M+Na-2H]- 325.12820 172.0
[M]+ 304.15298 169.4
[M]- 304.15408 169.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.