CID 202472

10429-58-0

Structural Information

Molecular Formula
C24H25NO
SMILES
C1C(CC2=CC=CC=C21)NCCOC3=CC=CC=C3CC4=CC=CC=C4
InChI
InChI=1S/C24H25NO/c1-2-8-19(9-3-1)16-22-12-6-7-13-24(22)26-15-14-25-23-17-20-10-4-5-11-21(20)18-23/h1-13,23,25H,14-18H2
InChIKey
ZALTXFZQOCHXNY-UHFFFAOYSA-N
Compound name
N-[2-(2-benzylphenoxy)ethyl]-2,3-dihydro-1H-inden-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.1936 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.20088 183.1
[M+Na]+ 366.18282 187.7
[M-H]- 342.18632 192.6
[M+NH4]+ 361.22742 198.1
[M+K]+ 382.15676 181.0
[M+H-H2O]+ 326.19086 173.5
[M+HCOO]- 388.19180 205.6
[M+CH3COO]- 402.20745 193.1
[M+Na-2H]- 364.16827 186.3
[M]+ 343.19305 182.3
[M]- 343.19415 182.3
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.