CID 3312177

N,n-diisopropylisobutylamine

Structural Information

Molecular Formula

C₁₀H₂₃N

SMILES

CC(C)CN(C(C)C)C(C)C

InChI

InChI=1S/C10H23N/c1-8(2)7-11(9(3)4)10(5)6/h8-10H,7H2,1-6H3

InChIKey

GGAIWRNUQIHLRE-UHFFFAOYSA-N

Compound name

2-methyl-N,N-di(propan-2-yl)propan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 306
Patents: 157.18304 Da
Monoisotopic Mass: 3.2
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]+	158.19032	142.1
[M+Na]+	180.17226	146.4
[M-H]-	156.17576	143.5
[M+NH4]+	175.21686	163.6
[M+K]+	196.14620	147.9
[M+H-H2O]+	140.18030	136.8
[M+HCOO]-	202.18124	163.1
[M+CH3COO]-	216.19689	190.4
[M+Na-2H]-	178.15771	142.7
[M]+	157.18249	143.4
[M]-	157.18359	143.4

Literature stripe

literature stripe

Patent stripe

patents stripe