CID 7408404

H-gln(trt)-oh

Structural Information

Molecular Formula
C24H24N2O3
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NC(=O)CC[C@@H](C(=O)O)N
InChI
InChI=1S/C24H24N2O3/c25-21(23(28)29)16-17-22(27)26-24(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15,21H,16-17,25H2,(H,26,27)(H,28,29)/t21-/m0/s1
InChIKey
XIFFJPJZPDCOJH-NRFANRHFSA-N
Compound name
(2S)-2-amino-5-oxo-5-(tritylamino)pentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

388.17868 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.18596 195.8
[M+Na]+ 411.16790 206.3
[M+NH4]+ 406.21250 201.5
[M+K]+ 427.14184 200.3
[M-H]- 387.17140 201.0
[M+Na-2H]- 409.15335 204.7
[M]+ 388.17813 198.6
[M]- 388.17923 198.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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