CID 48038

66793-76-8

Structural Information

Molecular Formula
C9H21N
SMILES
CCCCCCCNCC
InChI
InChI=1S/C9H21N/c1-3-5-6-7-8-9-10-4-2/h10H,3-9H2,1-2H3
InChIKey
IUZZLNVABCISOI-UHFFFAOYSA-N
Compound name
N-ethylheptan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2133
Patents

143.1674 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.174676 136.6
[M+Na]+ 166.156618 141.7
[M-H]- 142.160124 136.3
[M+NH4]+ 161.201223 158.1
[M+K]+ 182.130558 140.7
[M+H-H2O]+ 126.164660 131.3
[M+HCOO]- 188.165601 160.4
[M+CH3COO]- 202.181251 181.2
[M+Na-2H]- 164.142066 142.3
[M]+ 143.16685142 138.2
[M]- 143.16794858 138.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe