CID 64678326

4-(azepan-1-yl)-2-methylbutan-2-amine

Structural Information

Molecular Formula
C11H24N2
SMILES
CC(C)(CCN1CCCCCC1)N
InChI
InChI=1S/C11H24N2/c1-11(2,12)7-10-13-8-5-3-4-6-9-13/h3-10,12H2,1-2H3
InChIKey
JKVMGGHPNDBTGP-UHFFFAOYSA-N
Compound name
4-(azepan-1-yl)-2-methylbutan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

184.19395 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.20123 144.4
[M+Na]+ 207.18317 151.1
[M+NH4]+ 202.22777 151.5
[M+K]+ 223.15711 147.3
[M-H]- 183.18667 145.3
[M+Na-2H]- 205.16862 148.5
[M]+ 184.19340 145.4
[M]- 184.19450 145.4
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

patents stripe