CID 1534297

62642-61-9

Structural Information

Molecular Formula

C₁₂H₁₉N₃O

SMILES

CCN(CC)CC1=CC=C(C=C1)C(=O)NN

InChI

InChI=1S/C12H19N3O/c1-3-15(4-2)9-10-5-7-11(8-6-10)12(16)14-13/h5-8H,3-4,9,13H2,1-2H3,(H,14,16)

InChIKey

GIGSNSOHCRCJJS-UHFFFAOYSA-N

Compound name

4-(diethylaminomethyl)benzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 221.15282 Da
Monoisotopic Mass: 0.9
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]+	222.16010	152.7
[M+Na]+	244.14204	157.4
[M-H]-	220.14554	157.0
[M+NH4]+	239.18664	170.6
[M+K]+	260.11598	156.2
[M+H-H2O]+	204.15008	145.2
[M+HCOO]-	266.15102	178.6
[M+CH3COO]-	280.16667	200.6
[M+Na-2H]-	242.12749	156.3
[M]+	221.15227	152.0
[M]-	221.15337	152.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe