CID 1275961

99981-48-3

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

CC(C)(C)N(C(=O)C1=CC=CC=C1)N

InChI

InChI=1S/C11H16N2O/c1-11(2,3)13(12)10(14)9-7-5-4-6-8-9/h4-8H,12H2,1-3H3

InChIKey

OQVSACGODYLLEZ-UHFFFAOYSA-N

Compound name

N-tert-butylbenzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 106
Patents: 192.12627 Da
Monoisotopic Mass: 1.6
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]+	193.133546	144.0
[M+Na]+	215.115488	149.6
[M-H]-	191.118994	148.5
[M+NH4]+	210.160093	163.4
[M+K]+	231.089428	149.1
[M+H-H2O]+	175.123530	137.8
[M+HCOO]-	237.124471	167.7
[M+CH3COO]-	251.140121	190.9
[M+Na-2H]-	213.100936	149.3
[M]+	192.12572142	142.8
[M]-	192.12681858	142.8

Literature stripe

literature stripe

Patent stripe

patents stripe