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 197.3
[M+Na]+ 382.30804 197.4
[M-H]- 358.31154 198.3
[M+NH4]+ 377.35264 207.6
[M+K]+ 398.28198 191.7
[M+H-H2O]+ 342.31608 187.5
[M+HCOO]- 404.31702 210.2
[M+CH3COO]- 418.33267 218.0
[M+Na-2H]- 380.29349 193.8
[M]+ 359.31827 195.7
[M]- 359.31937 195.7
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.