CID 559367

N-n-butyl-n-hexylamine

Structural Information

Molecular Formula
C10H23N
SMILES
CCCCCCNCCCC
InChI
InChI=1S/C10H23N/c1-3-5-7-8-10-11-9-6-4-2/h11H,3-10H2,1-2H3
InChIKey
UYZWCDKHEOBGLW-UHFFFAOYSA-N
Compound name
N-butylhexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

709
Patents

157.18304 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.19032 141.1
[M+Na]+ 180.17226 145.8
[M-H]- 156.17576 140.6
[M+NH4]+ 175.21686 162.1
[M+K]+ 196.14620 144.6
[M+H-H2O]+ 140.18030 135.7
[M+HCOO]- 202.18124 164.6
[M+CH3COO]- 216.19689 184.3
[M+Na-2H]- 178.15771 146.3
[M]+ 157.18249 143.1
[M]- 157.18359 143.1
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.