CID 43187042

(1-butylpiperidin-2-yl)methanamine

Structural Information

Molecular Formula
C10H22N2
SMILES
CCCCN1CCCCC1CN
InChI
InChI=1S/C10H22N2/c1-2-3-7-12-8-5-4-6-10(12)9-11/h10H,2-9,11H2,1H3
InChIKey
RNIKYSSEZFTHHG-UHFFFAOYSA-N
Compound name
(1-butylpiperidin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

170.1783 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.185576 142.9
[M+Na]+ 193.167518 146.8
[M-H]- 169.171024 143.3
[M+NH4]+ 188.212123 161.5
[M+K]+ 209.141458 144.9
[M+H-H2O]+ 153.175560 135.9
[M+HCOO]- 215.176501 161.8
[M+CH3COO]- 229.192151 183.4
[M+Na-2H]- 191.152966 146.0
[M]+ 170.17775142 137.9
[M]- 170.17884858 137.9
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