CID 215830

36398-89-7

Structural Information

Molecular Formula
C19H26ClNO3
SMILES
CC1C2CCC(C2)C1CN(CCO)C(=O)COC3=CC=C(C=C3)Cl
InChI
InChI=1S/C19H26ClNO3/c1-13-14-2-3-15(10-14)18(13)11-21(8-9-22)19(23)12-24-17-6-4-16(20)5-7-17/h4-7,13-15,18,22H,2-3,8-12H2,1H3
InChIKey
COHJKBANAHFAJP-UHFFFAOYSA-N
Compound name
2-(4-chlorophenoxy)-N-(2-hydroxyethyl)-N-[(3-methyl-2-bicyclo[2.2.1]heptanyl)methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.16013 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.16741 188.0
[M+Na]+ 374.14935 192.9
[M-H]- 350.15285 193.3
[M+NH4]+ 369.19395 206.7
[M+K]+ 390.12329 188.3
[M+H-H2O]+ 334.15739 182.4
[M+HCOO]- 396.15833 202.6
[M+CH3COO]- 410.17398 215.1
[M+Na-2H]- 372.13480 184.9
[M]+ 351.15958 191.6
[M]- 351.16068 191.6
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.