CID 2760991

(4-pentylphenyl)hydrazine hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₈N₂

SMILES

CCCCCC1=CC=C(C=C1)NN

InChI

InChI=1S/C11H18N2/c1-2-3-4-5-10-6-8-11(13-12)9-7-10/h6-9,13H,2-5,12H2,1H3

InChIKey

NQXRBSHZHVXZSN-UHFFFAOYSA-N

Compound name

(4-pentylphenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 178.147 Da
Monoisotopic Mass: 3.3
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]+	179.154276	140.9
[M+Na]+	201.136218	146.7
[M-H]-	177.139724	143.8
[M+NH4]+	196.180823	160.4
[M+K]+	217.110158	143.9
[M+H-H2O]+	161.144260	134.4
[M+HCOO]-	223.145201	166.2
[M+CH3COO]-	237.160851	187.6
[M+Na-2H]-	199.121666	146.9
[M]+	178.14645142	139.4
[M]-	178.14754858	139.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe