CID 44193172

(1s,5r)-1,3,3,5-tetramethylcyclohexan-1-amine

Structural Information

Molecular Formula
C10H21N
SMILES
C[C@H]1C[C@](CC(C1)(C)C)(C)N
InChI
InChI=1S/C10H21N/c1-8-5-9(2,3)7-10(4,11)6-8/h8H,5-7,11H2,1-4H3/t8-,10+/m1/s1
InChIKey
WCYNWVWYGZJUFX-SCZZXKLOSA-N
Compound name
(1S,5R)-1,3,3,5-tetramethylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.1674 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.17468 134.6
[M+Na]+ 178.15662 141.5
[M-H]- 154.16012 137.9
[M+NH4]+ 173.20122 159.7
[M+K]+ 194.13056 140.2
[M+H-H2O]+ 138.16466 131.1
[M+HCOO]- 200.16560 154.9
[M+CH3COO]- 214.18125 181.2
[M+Na-2H]- 176.14207 139.6
[M]+ 155.16685 130.3
[M]- 155.16795 130.3
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.