CID 115669

Cyclohexanol, 4-(2-(n-methyl)aminopropyl)-, sulfate

Structural Information

Molecular Formula
C10H21NO
SMILES
CC(CC1CCC(CC1)O)NC
InChI
InChI=1S/C10H21NO/c1-8(11-2)7-9-3-5-10(12)6-4-9/h8-12H,3-7H2,1-2H3
InChIKey
MMEAJBCHCLXXSO-UHFFFAOYSA-N
Compound name
4-[2-(methylamino)propyl]cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.16231 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.16959 141.2
[M+Na]+ 194.15153 149.9
[M+NH4]+ 189.19613 149.5
[M+K]+ 210.12547 144.4
[M-H]- 170.15503 143.1
[M+Na-2H]- 192.13698 145.0
[M]+ 171.16176 142.6
[M]- 171.16286 142.6
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.