CID 2773676

4-tert-butylphenylhydrazine hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₆N₂

SMILES

CC(C)(C)C1=CC=C(C=C1)NN

InChI

InChI=1S/C10H16N2/c1-10(2,3)8-4-6-9(12-11)7-5-8/h4-7,12H,11H2,1-3H3

InChIKey

QPKCNTDHLKSHGT-UHFFFAOYSA-N

Compound name

(4-tert-butylphenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 403
Patents: 164.13135 Da
Monoisotopic Mass: 2.9
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]+	165.138626	137.0
[M+Na]+	187.120568	143.8
[M-H]-	163.124074	140.5
[M+NH4]+	182.165173	157.3
[M+K]+	203.094508	141.6
[M+H-H2O]+	147.128610	131.4
[M+HCOO]-	209.129551	161.1
[M+CH3COO]-	223.145201	184.2
[M+Na-2H]-	185.106016	144.1
[M]+	164.13080142	134.6
[M]-	164.13189858	134.6

Literature stripe

literature stripe

Patent stripe

patents stripe