CID 3065448

Phenol, 4-isododecyl-2-(1-piperidinylmethyl)-

Structural Information

Molecular Formula
C24H41NO
SMILES
CC(C)CCCCCCCCCC1=CC(=C(C=C1)O)CN2CCCCC2
InChI
InChI=1S/C24H41NO/c1-21(2)13-9-6-4-3-5-7-10-14-22-15-16-24(26)23(19-22)20-25-17-11-8-12-18-25/h15-16,19,21,26H,3-14,17-18,20H2,1-2H3
InChIKey
YBRLWUCEZFCNHI-UHFFFAOYSA-N
Compound name
4-(10-methylundecyl)-2-(piperidin-1-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

359.31882 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.32610 197.7
[M+Na]+ 382.30804 208.0
[M+NH4]+ 377.35264 204.6
[M+K]+ 398.28198 198.7
[M-H]- 358.31154 200.9
[M+Na-2H]- 380.29349 201.7
[M]+ 359.31827 200.0
[M]- 359.31937 200.0
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.