CID 439356

L-tryptophanamide

Structural Information

Molecular Formula

C₁₁H₁₃N₃O

SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)N)N

InChI

InChI=1S/C11H13N3O/c12-9(11(13)15)5-7-6-14-10-4-2-1-3-8(7)10/h1-4,6,9,14H,5,12H2,(H2,13,15)/t9-/m0/s1

InChIKey

JLSKPBDKNIXMBS-VIFPVBQESA-N

Compound name

(2S)-2-amino-3-(1H-indol-3-yl)propanamide

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 14
References: 1263
Patents: 203.10587 Da
Monoisotopic Mass: 0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	204.11315	143.5
[M+Na]+	226.09509	150.9
[M-H]-	202.09859	145.0
[M+NH4]+	221.13969	162.3
[M+K]+	242.06903	146.9
[M+H-H2O]+	186.10313	136.8
[M+HCOO]-	248.10407	166.0
[M+CH3COO]-	262.11972	187.4
[M+Na-2H]-	224.08054	147.7
[M]+	203.10532	140.3
[M]-	203.10642	140.3

Literature stripe

literature stripe

Patent stripe

patents stripe