CID 11062646

N,n-diisopropylbutylamine

Structural Information

Molecular Formula
C10H23N
SMILES
CCCCN(C(C)C)C(C)C
InChI
InChI=1S/C10H23N/c1-6-7-8-11(9(2)3)10(4)5/h9-10H,6-8H2,1-5H3
InChIKey
KLVOSHOFGYMCCP-UHFFFAOYSA-N
Compound name
N,N-di(propan-2-yl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1161
Patents

157.18304 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.19032 142.2
[M+Na]+ 180.17226 146.7
[M-H]- 156.17576 143.4
[M+NH4]+ 175.21686 163.7
[M+K]+ 196.14620 147.7
[M+H-H2O]+ 140.18030 136.8
[M+HCOO]- 202.18124 164.2
[M+CH3COO]- 216.19689 189.5
[M+Na-2H]- 178.15771 144.0
[M]+ 157.18249 144.1
[M]- 157.18359 144.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.