CID 64774624

1,1-bis(4-methylcyclohexyl)methanamine hydrochloride

Structural Information

Molecular Formula
C15H29N
SMILES
CC1CCC(CC1)C(C2CCC(CC2)C)N
InChI
InChI=1S/C15H29N/c1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14/h11-15H,3-10,16H2,1-2H3
InChIKey
YYUYWBUXVSMCNM-UHFFFAOYSA-N
Compound name
bis(4-methylcyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.23 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.23728 158.5
[M+Na]+ 246.21922 159.2
[M-H]- 222.22272 162.6
[M+NH4]+ 241.26382 175.8
[M+K]+ 262.19316 156.5
[M+H-H2O]+ 206.22726 151.4
[M+HCOO]- 268.22820 173.1
[M+CH3COO]- 282.24385 194.6
[M+Na-2H]- 244.20467 156.5
[M]+ 223.22945 147.6
[M]- 223.23055 147.6
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.