PubChemLite - Gamma-glutamyl-n'-(2-hydroxyphenyl)hydrazide (C23H27N7O5)

Structural Information

Molecular Formula

SMILES

C1=CC=C(C(=C1)NNC(=O)CCC(C(=O)C2=CC(=C(C=C2)O)NNNNC3=CC=CC=C3O)N)O

InChI

InChI=1S/C23H27N7O5/c24-15(10-12-22(34)28-25-16-5-1-3-7-19(16)31)23(35)14-9-11-21(33)18(13-14)27-30-29-26-17-6-2-4-8-20(17)32/h1-9,11,13,15,25-27,29-33H,10,12,24H2,(H,28,34)

InChIKey

SPFKEURJRSGDTA-UHFFFAOYSA-N

Compound name

4-amino-5-[4-hydroxy-3-[2-[2-(2-hydroxyphenyl)hydrazinyl]hydrazinyl]phenyl]-N'-(2-hydroxyphenyl)-5-oxopentanehydrazide

Related CIDs

2D Structure

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]+	482.21465	202.1
[M+Na]+	504.19659	200.9
[M-H]-	480.20009	207.1
[M+NH4]+	499.24119	204.2
[M+K]+	520.17053	199.0
[M+H-H2O]+	464.20463	190.8
[M+HCOO]-	526.20557	224.6
[M+CH3COO]-	540.22122	252.9
[M+Na-2H]-	502.18204	204.7
[M]+	481.20682	196.3
[M]-	481.20792	196.3

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

482.21465

202.1

[M+Na]+

504.19659

200.9

[M-H]-

480.20009

207.1

[M+NH4]+

499.24119

204.2

[M+K]+

520.17053

199.0

[M+H-H2O]+

464.20463

190.8

[M+HCOO]-

526.20557

224.6

[M+CH3COO]-

540.22122

252.9

[M+Na-2H]-

502.18204

204.7

[M]+

481.20682

196.3

[M]-

481.20792

196.3

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Gamma-glutamyl-n'-(2-hydroxyphenyl)hydrazide

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

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