CID 6484201

4-(aminomethyl)-n,n,1-trimethylpiperidin-4-amine

Structural Information

Molecular Formula
C9H21N3
SMILES
CN1CCC(CC1)(CN)N(C)C
InChI
InChI=1S/C9H21N3/c1-11(2)9(8-10)4-6-12(3)7-5-9/h4-8,10H2,1-3H3
InChIKey
YLOZCKVJAIJJEJ-UHFFFAOYSA-N
Compound name
4-(aminomethyl)-N,N,1-trimethylpiperidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

53
Patents

171.17355 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.18083 140.7
[M+Na]+ 194.16277 145.3
[M-H]- 170.16627 143.2
[M+NH4]+ 189.20737 161.6
[M+K]+ 210.13671 145.3
[M+H-H2O]+ 154.17081 134.3
[M+HCOO]- 216.17175 161.5
[M+CH3COO]- 230.18740 188.3
[M+Na-2H]- 192.14822 145.1
[M]+ 171.17300 136.2
[M]- 171.17410 136.2
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