CID 44145106

N,n-diisobutylisononylamine

Structural Information

Molecular Formula
C17H37N
SMILES
CC(C)CCCCCCN(CC(C)C)CC(C)C
InChI
InChI=1S/C17H37N/c1-15(2)11-9-7-8-10-12-18(13-16(3)4)14-17(5)6/h15-17H,7-14H2,1-6H3
InChIKey
ZVGMAEJCIAGEHJ-UHFFFAOYSA-N
Compound name
7-methyl-N,N-bis(2-methylpropyl)octan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.2926 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.299876 175.1
[M+Na]+ 278.281818 176.5
[M-H]- 254.285324 175.1
[M+NH4]+ 273.326423 192.7
[M+K]+ 294.255758 176.1
[M+H-H2O]+ 238.289860 168.5
[M+HCOO]- 300.290801 193.8
[M+CH3COO]- 314.306451 211.3
[M+Na-2H]- 276.267266 171.9
[M]+ 255.29205142 179.1
[M]- 255.29314858 179.1
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.