CID 200966

3,3'-dimesyloxy-n-cyclohexyldipropylamine hydrochloride

Structural Information

Molecular Formula
C14H29NO6S2
SMILES
CS(=O)(=O)OCCCN(CCCOS(=O)(=O)C)C1CCCCC1
InChI
InChI=1S/C14H29NO6S2/c1-22(16,17)20-12-6-10-15(14-8-4-3-5-9-14)11-7-13-21-23(2,18)19/h14H,3-13H2,1-2H3
InChIKey
KIYWJSMYLPLLDK-UHFFFAOYSA-N
Compound name
3-[cyclohexyl(3-methylsulfonyloxypropyl)amino]propyl methanesulfonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.14362 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.15090 184.7
[M+Na]+ 394.13284 186.2
[M-H]- 370.13634 186.7
[M+NH4]+ 389.17744 196.7
[M+K]+ 410.10678 184.0
[M+H-H2O]+ 354.14088 177.4
[M+HCOO]- 416.14182 192.7
[M+CH3COO]- 430.15747 213.6
[M+Na-2H]- 392.11829 186.0
[M]+ 371.14307 190.1
[M]- 371.14417 190.1
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.