CID 65391961

(1,4,4-trimethylcyclohexyl)methanamine

Structural Information

Molecular Formula
C10H21N
SMILES
CC1(CCC(CC1)(C)CN)C
InChI
InChI=1S/C10H21N/c1-9(2)4-6-10(3,8-11)7-5-9/h4-8,11H2,1-3H3
InChIKey
ZODLBQCWLXDQOX-UHFFFAOYSA-N
Compound name
(1,4,4-trimethylcyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.1674 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.17468 136.7
[M+Na]+ 178.15662 146.8
[M+NH4]+ 173.20122 148.8
[M+K]+ 194.13056 136.6
[M-H]- 154.16012 139.7
[M+Na-2H]- 176.14207 144.7
[M]+ 155.16685 139.2
[M]- 155.16795 139.2
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

No patent data available for this compound.