CID 222628

2-chloroethyl trityl ether

Structural Information

Molecular Formula
C21H19ClO
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCCCl
InChI
InChI=1S/C21H19ClO/c22-16-17-23-21(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2
InChIKey
SYWFBBWOXLVTAN-UHFFFAOYSA-N
Compound name
[2-chloroethoxy(diphenyl)methyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

322.11246 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.11974 177.0
[M+Na]+ 345.10168 183.1
[M-H]- 321.10518 185.5
[M+NH4]+ 340.14628 191.0
[M+K]+ 361.07562 176.1
[M+H-H2O]+ 305.10972 168.2
[M+HCOO]- 367.11066 194.1
[M+CH3COO]- 381.12631 187.6
[M+Na-2H]- 343.08713 183.6
[M]+ 322.11191 178.9
[M]- 322.11301 178.9
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

patents stripe